ID 3HQQA STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 3 2 GLN A 280 279 LYS I Protein S 1 FT #SUB 4 3 LEU A 284 283 SER I Protein S 6 FT #SUB 4 3 LEU A 288 287 VAL I Protein S 1 FT #SUB 4 3 LEU A 370 369 LEU I Protein S 1 FT #SUB 7 6 ASN A 280 279 LYS I Protein S 4 FT #SUB 7 6 ASN A 281 280 ILE I Protein B 3 FT #SUB 7 6 ASN A 284 283 SER I Protein S 1 FT #SUB 8 7 LEU A 285 284 LYS I Protein S 3 FT #SUB 10 9 LEU A 277 276 VAL I Protein S 2 FT #SUB 12 11 ILE A 274 273 LYS I Protein A 3 FT #SUB 13 12 PHE A 243 242 HIS I Protein S 4 FT #SUB 243 242 HIS A 12 11 ILE I Protein S 2 FT #SUB 243 242 HIS A 13 12 PHE I Protein S 10 FT #SUB 263 262 ARG A 311 310 ARG I Protein B 3 FT #SUB 264 263 GLY A 311 310 ARG I Protein B 3 FT #SUB 267 266 GLY A 311 310 ARG I Protein B 5 FT #SUB 268 267 VAL A 311 310 ARG I Protein A 2 FT #SUB 272 271 ALA A 314 313 VAL I Protein A 3 FT #SUB 273 272 GLU A 314 313 VAL I Protein B 2 FT #SUB 273 272 GLU A 349 348 ARG I Protein S 3 FT #SUB 273 272 GLU A 350 349 ILE I Protein S 2 FT #SUB 273 272 GLU A 353 352 GLU I Protein A 3 FT #SUB 274 273 LYS A 353 352 GLU I Protein S 5 FT #SUB 276 275 VAL A 315 314 SER I Protein S 2 FT #SUB 276 275 VAL A 318 317 ALA I Protein S 2 FT #SUB 276 275 VAL A 322 321 PHE I Protein S 1 FT #SUB 280 279 LYS A 3 2 GLN I Protein S 1 FT #SUB 280 279 LYS A 7 6 ASN I Protein S 2 FT #SUB 281 280 ILE A 7 6 ASN I Protein S 2 FT #SUB 281 280 ILE A 10 9 LEU I Protein S 2 FT #SUB 284 283 SER A 4 3 LEU I Protein A 5 FT #SUB 284 283 SER A 7 6 ASN I Protein S 1 FT #SUB 285 284 LYS A 8 7 LEU I Protein S 2 FT #SUB 288 287 VAL A 4 3 LEU I Protein S 1 FT #SUB 298 297 GLN A 310 309 THR I Protein S 3 FT #SUB 298 297 GLN A 311 310 ARG I Protein S 3 FT #SUB 298 297 GLN A 312 311 ALA I Protein B 1 FT #SUB 311 310 ARG A 263 262 ARG I Protein S 1 FT #SUB 311 310 ARG A 264 263 GLY I Protein S 2 FT #SUB 311 310 ARG A 267 266 GLY I Protein S 6 FT #SUB 311 310 ARG A 268 267 VAL I Protein S 2 FT #SUB 311 310 ARG A 298 297 GLN I Protein A 5 FT #SUB 312 311 ALA A 298 297 GLN I Protein S 1 FT #SUB 314 313 VAL A 272 271 ALA I Protein S 2 FT #SUB 314 313 VAL A 273 272 GLU I Protein S 2 FT #SUB 315 314 SER A 276 275 VAL I Protein B 1 FT #SUB 315 314 SER A 316 315 ASP I Protein S 1 FT #SUB 316 315 ASP A 315 314 SER I Protein S 1 FT #SUB 322 321 PHE A 276 275 VAL I Protein S 1 FT #SUB 350 349 ILE A 273 272 GLU I Protein S 1 FT #SUB 353 352 GLU A 273 272 GLU I Protein S 3 FT #SUB 353 352 GLU A 274 273 LYS I Protein S 3 FT #SUB 370 369 LEU A 4 3 LEU I Protein S 1 FT #SUB 373 372 ILE A 391 390 GLU J Protein S 1 FT #SUB 374 373 PRO A 391 390 GLU J Protein A 2 FT #SUB 377 376 ALA A 495 494 ILE J Protein B 1 FT #SUB 380 379 ALA A 391 390 GLU J Protein A 3 FT #SUB 383 382 SER A 391 390 GLU J Protein S 3 FT #SUB 384 383 SER A 384 383 SER J Protein A 6 FT #SUB 384 383 SER A 387 386 ASN J Protein S 1 FT #SUB 384 383 SER A 388 387 SER J Protein S 1 FT #SUB 387 386 ASN A 368 367 LYS J Protein S 1 FT #SUB 388 387 SER A 380 379 ALA J Protein S 2 FT #SUB 388 387 SER A 384 383 SER J Protein S 2 FT #SUB 390 389 TYR A 373 372 ILE J Protein B 2 FT #SUB 391 390 GLU A 368 367 LYS J Protein S 1 FT #SUB 391 390 GLU A 373 372 ILE J Protein B 9 FT #SUB 391 390 GLU A 374 373 PRO J Protein B 5 FT #SUB 391 390 GLU A 375 374 MET J Protein A 5 FT #SUB 391 390 GLU A 380 379 ALA J Protein S 2 FT #SUB 391 390 GLU A 383 382 SER J Protein S 3 FT #SUB 392 391 THR A 374 373 PRO J Protein B 6 FT #SUB 393 392 LYS A 373 372 ILE J Protein S 2 FT #SUB 393 392 LYS A 374 373 PRO J Protein A 4 FT #SUB 483 482 ASP A 494 493 ARG J Protein S 2 FT #SUB 484 483 HIS A 484 483 HIS J Protein S 4 FT #SUB 491 490 ASN A 493 492 THR J Protein B 1 FT #SUB 491 490 ASN A 494 493 ARG J Protein B 1 FT #SUB 491 490 ASN A 495 494 ILE J Protein A 2 FT #SUB 492 491 GLN A 492 491 GLN J Protein S 8 FT #SUB 492 491 GLN A 493 492 THR J Protein A 2 FT #SUB 493 492 THR A 491 490 ASN J Protein B 1 FT #SUB 493 492 THR A 492 491 GLN J Protein B 1 FT #SUB 493 492 THR A 493 492 THR J Protein A 3 FT #SUB 494 493 ARG A 483 482 ASP J Protein S 3 FT #SUB 494 493 ARG A 491 490 ASN J Protein A 2 FT #SUB 495 494 ILE A 377 376 ALA J Protein S 4 FT #SUB 495 494 ILE A 380 379 ALA J Protein S 1 FT #SUB 495 494 ILE A 491 490 ASN J Protein B 2 FT #HET 400 399 LEU A 1 700 FDP A A 11 FT #HET 401 400 SER A 1 700 FDP A A 9 FT #HET 402 401 ASN A 1 700 FDP A A 12 FT #HET 403 402 THR A 1 700 FDP A A 11 FT #HET 405 404 ARG A 1 700 FDP A A 5 FT #HET 406 405 SER A 1 700 FDP A A 7 FT #HET 454 453 LYS A 1 700 FDP A S 8 FT #HET 457 456 ARG A 1 700 FDP A S 9 FT #HET 480 479 ILE A 1 700 FDP A B 1 FT #HET 481 480 HIS A 1 700 FDP A A 3 FT #HET 482 481 ALA A 1 700 FDP A A 4 FT #HET 487 486 LYS A 1 700 FDP A B 1 FT #HET 488 487 GLY A 1 700 FDP A B 1 FT #HET 489 488 TYR A 1 700 FDP A B 2 FT #HET 490 489 ALA A 1 700 FDP A S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQB STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 4 3 LEU B 284 283 SER C Protein S 2 FT #SUB 4 3 LEU B 366 365 SER C Protein S 3 FT #SUB 4 3 LEU B 370 369 LEU C Protein S 1 FT #SUB 7 6 ASN B 280 279 LYS C Protein S 2 FT #SUB 7 6 ASN B 281 280 ILE C Protein B 1 FT #SUB 7 6 ASN B 284 283 SER C Protein S 1 FT #SUB 8 7 LEU B 285 284 LYS C Protein S 1 FT #SUB 10 9 LEU B 277 276 VAL C Protein S 1 FT #SUB 10 9 LEU B 281 280 ILE C Protein B 2 FT #SUB 12 11 ILE B 270 269 ILE C Protein S 1 FT #SUB 12 11 ILE B 274 273 LYS C Protein A 5 FT #SUB 13 12 PHE B 243 242 HIS C Protein S 6 FT #SUB 243 242 HIS B 13 12 PHE C Protein S 4 FT #SUB 263 262 ARG B 311 310 ARG C Protein A 2 FT #SUB 264 263 GLY B 311 310 ARG C Protein B 3 FT #SUB 270 269 ILE B 12 11 ILE C Protein S 1 FT #SUB 273 272 GLU B 353 352 GLU C Protein A 17 FT #SUB 274 273 LYS B 12 11 ILE C Protein A 10 FT #SUB 274 273 LYS B 353 352 GLU C Protein A 5 FT #SUB 276 275 VAL B 322 321 PHE C Protein S 2 FT #SUB 277 276 VAL B 10 9 LEU C Protein S 3 FT #SUB 277 276 VAL B 11 10 SER C Protein S 2 FT #SUB 277 276 VAL B 353 352 GLU C Protein S 1 FT #SUB 278 277 ALA B 12 11 ILE C Protein S 1 FT #SUB 280 279 LYS B 3 2 GLN C Protein S 2 FT #SUB 280 279 LYS B 7 6 ASN C Protein A 10 FT #SUB 281 280 ILE B 7 6 ASN C Protein A 5 FT #SUB 281 280 ILE B 10 9 LEU C Protein S 4 FT #SUB 284 283 SER B 4 3 LEU C Protein A 4 FT #SUB 284 283 SER B 7 6 ASN C Protein S 2 FT #SUB 285 284 LYS B 8 7 LEU C Protein S 1 FT #SUB 297 296 THR B 311 310 ARG C Protein B 2 FT #SUB 298 297 GLN B 310 309 THR C Protein S 3 FT #SUB 298 297 GLN B 311 310 ARG C Protein S 21 FT #SUB 298 297 GLN B 312 311 ALA C Protein B 3 FT #SUB 299 298 MET B 312 311 ALA C Protein B 1 FT #SUB 310 309 THR B 298 297 GLN C Protein B 1 FT #SUB 311 310 ARG B 263 262 ARG C Protein S 5 FT #SUB 311 310 ARG B 264 263 GLY C Protein S 4 FT #SUB 311 310 ARG B 297 296 THR C Protein S 2 FT #SUB 311 310 ARG B 298 297 GLN C Protein A 14 FT #SUB 312 311 ALA B 298 297 GLN C Protein A 2 FT #SUB 312 311 ALA B 299 298 MET C Protein S 1 FT #SUB 312 311 ALA B 312 311 ALA C Protein A 10 FT #SUB 312 311 ALA B 313 312 GLU C Protein S 4 FT #SUB 312 311 ALA B 316 315 ASP C Protein A 11 FT #SUB 313 312 GLU B 312 311 ALA C Protein A 4 FT #SUB 315 314 SER B 316 315 ASP C Protein S 3 FT #SUB 316 315 ASP B 312 311 ALA C Protein S 5 FT #SUB 316 315 ASP B 315 314 SER C Protein A 6 FT #SUB 319 318 ASN B 319 318 ASN C Protein S 13 FT #SUB 349 348 ARG B 273 272 GLU C Protein S 3 FT #SUB 353 352 GLU B 273 272 GLU C Protein S 9 FT #SUB 353 352 GLU B 274 273 LYS C Protein S 1 FT #SUB 353 352 GLU B 277 276 VAL C Protein S 1 FT #SUB 103 102 GLU B 58 57 HIS G Protein S 4 FT #SUB 104 103 ARG B 59 58 GLU G Protein A 6 FT #SUB 169 168 SER B 59 58 GLU G Protein S 5 FT #SUB 368 367 LYS B 387 386 ASN O Protein S 1 FT #SUB 368 367 LYS B 391 390 GLU O Protein S 1 FT #SUB 373 372 ILE B 390 389 TYR O Protein S 2 FT #SUB 373 372 ILE B 391 390 GLU O Protein A 10 FT #SUB 373 372 ILE B 393 392 LYS O Protein A 2 FT #SUB 374 373 PRO B 391 390 GLU O Protein A 5 FT #SUB 374 373 PRO B 392 391 THR O Protein A 7 FT #SUB 374 373 PRO B 393 392 LYS O Protein A 3 FT #SUB 375 374 MET B 391 390 GLU O Protein A 5 FT #SUB 377 376 ALA B 495 494 ILE O Protein A 4 FT #SUB 380 379 ALA B 388 387 SER O Protein A 2 FT #SUB 380 379 ALA B 391 390 GLU O Protein A 2 FT #SUB 380 379 ALA B 495 494 ILE O Protein S 1 FT #SUB 383 382 SER B 391 390 GLU O Protein S 3 FT #SUB 384 383 SER B 384 383 SER O Protein A 7 FT #SUB 384 383 SER B 388 387 SER O Protein S 2 FT #SUB 387 386 ASN B 384 383 SER O Protein S 1 FT #SUB 391 390 GLU B 373 372 ILE O Protein B 3 FT #SUB 391 390 GLU B 374 373 PRO O Protein B 3 FT #SUB 391 390 GLU B 375 374 MET O Protein A 2 FT #SUB 391 390 GLU B 380 379 ALA O Protein S 3 FT #SUB 391 390 GLU B 383 382 SER O Protein S 3 FT #SUB 392 391 THR B 374 373 PRO O Protein B 3 FT #SUB 483 482 ASP B 494 493 ARG O Protein S 3 FT #SUB 484 483 HIS B 484 483 HIS O Protein S 4 FT #SUB 491 490 ASN B 493 492 THR O Protein B 1 FT #SUB 491 490 ASN B 494 493 ARG O Protein B 2 FT #SUB 491 490 ASN B 495 494 ILE O Protein B 1 FT #SUB 492 491 GLN B 492 491 GLN O Protein S 8 FT #SUB 492 491 GLN B 493 492 THR O Protein B 1 FT #SUB 493 492 THR B 491 490 ASN O Protein B 1 FT #SUB 493 492 THR B 492 491 GLN O Protein B 1 FT #SUB 493 492 THR B 493 492 THR O Protein A 3 FT #SUB 494 493 ARG B 483 482 ASP O Protein S 2 FT #SUB 494 493 ARG B 491 490 ASN O Protein B 1 FT #SUB 495 494 ILE B 377 376 ALA O Protein S 1 FT #SUB 495 494 ILE B 491 490 ASN O Protein B 1 FT #HET 400 399 LEU B 2 700 FDP B A 11 FT #HET 401 400 SER B 2 700 FDP B A 9 FT #HET 402 401 ASN B 2 700 FDP B A 12 FT #HET 403 402 THR B 2 700 FDP B A 11 FT #HET 405 404 ARG B 2 700 FDP B A 5 FT #HET 406 405 SER B 2 700 FDP B A 7 FT #HET 454 453 LYS B 2 700 FDP B S 8 FT #HET 457 456 ARG B 2 700 FDP B S 9 FT #HET 480 479 ILE B 2 700 FDP B B 1 FT #HET 481 480 HIS B 2 700 FDP B A 3 FT #HET 482 481 ALA B 2 700 FDP B A 4 FT #HET 487 486 LYS B 2 700 FDP B B 1 FT #HET 488 487 GLY B 2 700 FDP B B 1 FT #HET 489 488 TYR B 2 700 FDP B B 2 FT #HET 490 489 ALA B 2 700 FDP B S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQC STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 3 2 GLN C 280 279 LYS B Protein S 2 FT #SUB 4 3 LEU C 284 283 SER B Protein S 4 FT #SUB 7 6 ASN C 280 279 LYS B Protein S 10 FT #SUB 7 6 ASN C 281 280 ILE B Protein B 5 FT #SUB 7 6 ASN C 284 283 SER B Protein S 2 FT #SUB 8 7 LEU C 285 284 LYS B Protein S 1 FT #SUB 10 9 LEU C 277 276 VAL B Protein A 3 FT #SUB 10 9 LEU C 281 280 ILE B Protein A 4 FT #SUB 11 10 SER C 277 276 VAL B Protein B 2 FT #SUB 12 11 ILE C 270 269 ILE B Protein S 1 FT #SUB 12 11 ILE C 274 273 LYS B Protein A 10 FT #SUB 12 11 ILE C 278 277 ALA B Protein S 1 FT #SUB 13 12 PHE C 243 242 HIS B Protein S 4 FT #SUB 243 242 HIS C 13 12 PHE B Protein S 6 FT #SUB 263 262 ARG C 311 310 ARG B Protein A 5 FT #SUB 264 263 GLY C 311 310 ARG B Protein B 4 FT #SUB 270 269 ILE C 12 11 ILE B Protein S 1 FT #SUB 273 272 GLU C 349 348 ARG B Protein S 3 FT #SUB 273 272 GLU C 353 352 GLU B Protein A 9 FT #SUB 274 273 LYS C 12 11 ILE B Protein A 5 FT #SUB 274 273 LYS C 353 352 GLU B Protein S 1 FT #SUB 277 276 VAL C 10 9 LEU B Protein S 1 FT #SUB 277 276 VAL C 353 352 GLU B Protein S 1 FT #SUB 280 279 LYS C 7 6 ASN B Protein S 2 FT #SUB 281 280 ILE C 7 6 ASN B Protein S 1 FT #SUB 281 280 ILE C 10 9 LEU B Protein S 2 FT #SUB 284 283 SER C 4 3 LEU B Protein S 2 FT #SUB 284 283 SER C 7 6 ASN B Protein S 1 FT #SUB 285 284 LYS C 8 7 LEU B Protein S 1 FT #SUB 297 296 THR C 311 310 ARG B Protein B 2 FT #SUB 298 297 GLN C 310 309 THR B Protein S 1 FT #SUB 298 297 GLN C 311 310 ARG B Protein S 14 FT #SUB 298 297 GLN C 312 311 ALA B Protein B 2 FT #SUB 299 298 MET C 312 311 ALA B Protein B 1 FT #SUB 310 309 THR C 298 297 GLN B Protein B 3 FT #SUB 311 310 ARG C 263 262 ARG B Protein S 2 FT #SUB 311 310 ARG C 264 263 GLY B Protein S 3 FT #SUB 311 310 ARG C 297 296 THR B Protein S 2 FT #SUB 311 310 ARG C 298 297 GLN B Protein A 21 FT #SUB 312 311 ALA C 298 297 GLN B Protein A 3 FT #SUB 312 311 ALA C 299 298 MET B Protein S 1 FT #SUB 312 311 ALA C 312 311 ALA B Protein A 10 FT #SUB 312 311 ALA C 313 312 GLU B Protein S 4 FT #SUB 312 311 ALA C 316 315 ASP B Protein A 5 FT #SUB 313 312 GLU C 312 311 ALA B Protein A 4 FT #SUB 315 314 SER C 316 315 ASP B Protein S 6 FT #SUB 316 315 ASP C 312 311 ALA B Protein S 11 FT #SUB 316 315 ASP C 315 314 SER B Protein A 3 FT #SUB 319 318 ASN C 319 318 ASN B Protein S 13 FT #SUB 322 321 PHE C 276 275 VAL B Protein S 2 FT #SUB 353 352 GLU C 273 272 GLU B Protein S 17 FT #SUB 353 352 GLU C 274 273 LYS B Protein S 5 FT #SUB 353 352 GLU C 277 276 VAL B Protein S 1 FT #SUB 366 365 SER C 4 3 LEU B Protein A 3 FT #SUB 370 369 LEU C 4 3 LEU B Protein S 1 FT #SUB 57 56 SER C 169 168 SER E Protein S 4 FT #SUB 58 57 HIS C 103 102 GLU E Protein S 15 FT #SUB 59 58 GLU C 104 103 ARG E Protein S 15 FT #SUB 94 93 GLN C 176 175 ARG E Protein S 1 FT #SUB 97 96 GLY C 336 335 LYS E Protein B 1 FT #SUB 175 174 ARG C 173 172 SER E Protein S 6 FT #SUB 193 192 LYS C 101 100 VAL E Protein S 2 FT #SUB 196 195 VAL C 103 102 GLU E Protein S 2 FT #SUB 196 195 VAL C 122 121 LYS E Protein S 2 FT #SUB 217 216 ALA C 447 446 LYS N Protein A 10 FT #SUB 218 217 GLU C 447 446 LYS N Protein B 1 FT #SUB 218 217 GLU C 448 447 LEU N Protein S 4 FT #SUB 218 217 GLU C 449 448 GLY N Protein S 3 FT #SUB 251 250 SER C 447 446 LYS N Protein A 12 FT #SUB 255 254 GLU C 447 446 LYS N Protein S 6 FT #SUB 373 372 ILE C 390 389 TYR P Protein S 1 FT #SUB 373 372 ILE C 391 390 GLU P Protein A 8 FT #SUB 374 373 PRO C 391 390 GLU P Protein A 7 FT #SUB 374 373 PRO C 392 391 THR P Protein S 5 FT #SUB 374 373 PRO C 393 392 LYS P Protein S 1 FT #SUB 375 374 MET C 391 390 GLU P Protein A 4 FT #SUB 377 376 ALA C 495 494 ILE P Protein A 3 FT #SUB 380 379 ALA C 388 387 SER P Protein S 1 FT #SUB 380 379 ALA C 391 390 GLU P Protein A 2 FT #SUB 383 382 SER C 391 390 GLU P Protein S 1 FT #SUB 384 383 SER C 384 383 SER P Protein S 4 FT #SUB 388 387 SER C 380 379 ALA P Protein S 1 FT #SUB 390 389 TYR C 373 372 ILE P Protein B 4 FT #SUB 391 390 GLU C 373 372 ILE P Protein A 18 FT #SUB 391 390 GLU C 374 373 PRO P Protein B 5 FT #SUB 391 390 GLU C 375 374 MET P Protein A 5 FT #SUB 391 390 GLU C 380 379 ALA P Protein S 2 FT #SUB 391 390 GLU C 383 382 SER P Protein S 1 FT #SUB 392 391 THR C 374 373 PRO P Protein B 5 FT #SUB 393 392 LYS C 374 373 PRO P Protein S 1 FT #SUB 483 482 ASP C 494 493 ARG P Protein S 2 FT #SUB 484 483 HIS C 484 483 HIS P Protein S 4 FT #SUB 491 490 ASN C 493 492 THR P Protein B 1 FT #SUB 491 490 ASN C 494 493 ARG P Protein A 2 FT #SUB 492 491 GLN C 492 491 GLN P Protein S 9 FT #SUB 492 491 GLN C 493 492 THR P Protein B 1 FT #SUB 493 492 THR C 491 490 ASN P Protein B 1 FT #SUB 493 492 THR C 492 491 GLN P Protein B 1 FT #SUB 494 493 ARG C 483 482 ASP P Protein S 2 FT #SUB 494 493 ARG C 491 490 ASN P Protein A 2 FT #SUB 495 494 ILE C 377 376 ALA P Protein S 5 FT #SUB 495 494 ILE C 380 379 ALA P Protein S 1 FT #SUB 473 472 THR C 192 191 ALA V Protein B 2 FT #SUB 474 473 GLY C 192 191 ALA V Protein B 3 FT #SUB 497 496 LEU C 196 195 VAL V Protein S 7 FT #SUB 498 497 VAL C 196 195 VAL V Protein B 1 FT #SUB 499 498 GLU C 58 57 HIS V Protein S 1 FT #SUB 499 498 GLU C 196 195 VAL V Protein S 2 FT #HET 400 399 LEU C 3 700 FDP C A 11 FT #HET 401 400 SER C 3 700 FDP C A 9 FT #HET 402 401 ASN C 3 700 FDP C A 12 FT #HET 403 402 THR C 3 700 FDP C A 11 FT #HET 405 404 ARG C 3 700 FDP C A 5 FT #HET 406 405 SER C 3 700 FDP C A 7 FT #HET 454 453 LYS C 3 700 FDP C S 8 FT #HET 457 456 ARG C 3 700 FDP C S 9 FT #HET 480 479 ILE C 3 700 FDP C B 1 FT #HET 481 480 HIS C 3 700 FDP C A 3 FT #HET 482 481 ALA C 3 700 FDP C A 4 FT #HET 487 486 LYS C 3 700 FDP C B 1 FT #HET 488 487 GLY C 3 700 FDP C B 1 FT #HET 489 488 TYR C 3 700 FDP C B 2 FT #HET 490 489 ALA C 3 700 FDP C S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQD STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 368 367 LYS D 368 367 LYS E Protein S 1 FT #SUB 368 367 LYS D 387 386 ASN E Protein S 1 FT #SUB 368 367 LYS D 391 390 GLU E Protein S 1 FT #SUB 373 372 ILE D 390 389 TYR E Protein S 1 FT #SUB 373 372 ILE D 391 390 GLU E Protein A 10 FT #SUB 373 372 ILE D 393 392 LYS E Protein S 1 FT #SUB 374 373 PRO D 391 390 GLU E Protein A 5 FT #SUB 374 373 PRO D 392 391 THR E Protein A 5 FT #SUB 374 373 PRO D 393 392 LYS E Protein S 1 FT #SUB 375 374 MET D 391 390 GLU E Protein A 4 FT #SUB 377 376 ALA D 495 494 ILE E Protein A 4 FT #SUB 380 379 ALA D 388 387 SER E Protein A 2 FT #SUB 380 379 ALA D 391 390 GLU E Protein A 2 FT #SUB 380 379 ALA D 495 494 ILE E Protein S 1 FT #SUB 383 382 SER D 391 390 GLU E Protein S 3 FT #SUB 384 383 SER D 384 383 SER E Protein A 8 FT #SUB 384 383 SER D 388 387 SER E Protein S 1 FT #SUB 387 386 ASN D 383 382 SER E Protein S 1 FT #SUB 387 386 ASN D 384 383 SER E Protein S 1 FT #SUB 388 387 SER D 380 379 ALA E Protein S 2 FT #SUB 388 387 SER D 384 383 SER E Protein S 1 FT #SUB 390 389 TYR D 373 372 ILE E Protein B 1 FT #SUB 391 390 GLU D 373 372 ILE E Protein B 7 FT #SUB 391 390 GLU D 374 373 PRO E Protein B 5 FT #SUB 391 390 GLU D 375 374 MET E Protein A 4 FT #SUB 391 390 GLU D 380 379 ALA E Protein S 4 FT #SUB 391 390 GLU D 383 382 SER E Protein S 4 FT #SUB 392 391 THR D 374 373 PRO E Protein B 4 FT #SUB 393 392 LYS D 373 372 ILE E Protein S 2 FT #SUB 393 392 LYS D 374 373 PRO E Protein A 3 FT #SUB 483 482 ASP D 494 493 ARG E Protein S 3 FT #SUB 484 483 HIS D 484 483 HIS E Protein S 4 FT #SUB 491 490 ASN D 493 492 THR E Protein B 1 FT #SUB 491 490 ASN D 494 493 ARG E Protein B 3 FT #SUB 491 490 ASN D 495 494 ILE E Protein B 1 FT #SUB 492 491 GLN D 492 491 GLN E Protein S 12 FT #SUB 492 491 GLN D 493 492 THR E Protein B 1 FT #SUB 493 492 THR D 491 490 ASN E Protein B 1 FT #SUB 493 492 THR D 492 491 GLN E Protein B 4 FT #SUB 493 492 THR D 493 492 THR E Protein A 3 FT #SUB 494 493 ARG D 483 482 ASP E Protein S 4 FT #SUB 494 493 ARG D 491 490 ASN E Protein A 4 FT #SUB 495 494 ILE D 377 376 ALA E Protein S 6 FT #SUB 495 494 ILE D 380 379 ALA E Protein S 1 FT #SUB 495 494 ILE D 491 490 ASN E Protein B 1 FT #SUB 3 2 GLN D 280 279 LYS F Protein S 1 FT #SUB 4 3 LEU D 284 283 SER F Protein S 2 FT #SUB 4 3 LEU D 366 365 SER F Protein S 1 FT #SUB 4 3 LEU D 370 369 LEU F Protein S 1 FT #SUB 7 6 ASN D 280 279 LYS F Protein S 5 FT #SUB 7 6 ASN D 281 280 ILE F Protein B 1 FT #SUB 7 6 ASN D 284 283 SER F Protein S 1 FT #SUB 8 7 LEU D 285 284 LYS F Protein S 1 FT #SUB 10 9 LEU D 277 276 VAL F Protein S 1 FT #SUB 10 9 LEU D 281 280 ILE F Protein B 2 FT #SUB 12 11 ILE D 270 269 ILE F Protein S 1 FT #SUB 12 11 ILE D 274 273 LYS F Protein A 12 FT #SUB 13 12 PHE D 243 242 HIS F Protein S 7 FT #SUB 243 242 HIS D 13 12 PHE F Protein S 5 FT #SUB 263 262 ARG D 311 310 ARG F Protein A 2 FT #SUB 264 263 GLY D 311 310 ARG F Protein B 1 FT #SUB 270 269 ILE D 12 11 ILE F Protein S 1 FT #SUB 273 272 GLU D 353 352 GLU F Protein A 10 FT #SUB 274 273 LYS D 12 11 ILE F Protein A 8 FT #SUB 274 273 LYS D 353 352 GLU F Protein S 2 FT #SUB 277 276 VAL D 10 9 LEU F Protein S 1 FT #SUB 277 276 VAL D 353 352 GLU F Protein S 1 FT #SUB 280 279 LYS D 3 2 GLN F Protein S 1 FT #SUB 280 279 LYS D 7 6 ASN F Protein S 7 FT #SUB 281 280 ILE D 7 6 ASN F Protein S 2 FT #SUB 281 280 ILE D 10 9 LEU F Protein S 2 FT #SUB 284 283 SER D 4 3 LEU F Protein S 2 FT #SUB 284 283 SER D 7 6 ASN F Protein S 1 FT #SUB 285 284 LYS D 8 7 LEU F Protein S 1 FT #SUB 297 296 THR D 311 310 ARG F Protein B 2 FT #SUB 298 297 GLN D 311 310 ARG F Protein S 16 FT #SUB 298 297 GLN D 312 311 ALA F Protein B 2 FT #SUB 311 310 ARG D 263 262 ARG F Protein S 2 FT #SUB 311 310 ARG D 264 263 GLY F Protein S 2 FT #SUB 311 310 ARG D 297 296 THR F Protein S 2 FT #SUB 311 310 ARG D 298 297 GLN F Protein A 12 FT #SUB 312 311 ALA D 298 297 GLN F Protein S 1 FT #SUB 312 311 ALA D 312 311 ALA F Protein A 9 FT #SUB 312 311 ALA D 313 312 GLU F Protein S 3 FT #SUB 312 311 ALA D 316 315 ASP F Protein A 6 FT #SUB 313 312 GLU D 312 311 ALA F Protein A 3 FT #SUB 315 314 SER D 316 315 ASP F Protein S 2 FT #SUB 316 315 ASP D 312 311 ALA F Protein S 5 FT #SUB 316 315 ASP D 315 314 SER F Protein S 2 FT #SUB 319 318 ASN D 319 318 ASN F Protein S 9 FT #SUB 353 352 GLU D 273 272 GLU F Protein S 10 FT #SUB 353 352 GLU D 274 273 LYS F Protein S 2 FT #SUB 353 352 GLU D 277 276 VAL F Protein S 1 FT #SUB 370 369 LEU D 4 3 LEU F Protein S 1 FT #HET 400 399 LEU D 4 700 FDP D A 11 FT #HET 401 400 SER D 4 700 FDP D A 9 FT #HET 402 401 ASN D 4 700 FDP D A 12 FT #HET 403 402 THR D 4 700 FDP D A 11 FT #HET 405 404 ARG D 4 700 FDP D A 4 FT #HET 406 405 SER D 4 700 FDP D A 7 FT #HET 454 453 LYS D 4 700 FDP D S 8 FT #HET 457 456 ARG D 4 700 FDP D S 9 FT #HET 480 479 ILE D 4 700 FDP D B 1 FT #HET 481 480 HIS D 4 700 FDP D A 3 FT #HET 482 481 ALA D 4 700 FDP D A 4 FT #HET 487 486 LYS D 4 700 FDP D B 1 FT #HET 488 487 GLY D 4 700 FDP D B 1 FT #HET 489 488 TYR D 4 700 FDP D B 2 FT #HET 490 489 ALA D 4 700 FDP D S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQE STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 101 100 VAL E 193 192 LYS C Protein S 2 FT #SUB 103 102 GLU E 58 57 HIS C Protein S 15 FT #SUB 103 102 GLU E 196 195 VAL C Protein S 2 FT #SUB 104 103 ARG E 59 58 GLU C Protein S 15 FT #SUB 122 121 LYS E 196 195 VAL C Protein S 2 FT #SUB 169 168 SER E 57 56 SER C Protein S 4 FT #SUB 173 172 SER E 175 174 ARG C Protein S 6 FT #SUB 176 175 ARG E 94 93 GLN C Protein S 1 FT #SUB 336 335 LYS E 97 96 GLY C Protein S 1 FT #SUB 368 367 LYS E 368 367 LYS D Protein S 1 FT #SUB 373 372 ILE E 390 389 TYR D Protein S 1 FT #SUB 373 372 ILE E 391 390 GLU D Protein A 7 FT #SUB 373 372 ILE E 393 392 LYS D Protein A 2 FT #SUB 374 373 PRO E 391 390 GLU D Protein A 5 FT #SUB 374 373 PRO E 392 391 THR D Protein S 4 FT #SUB 374 373 PRO E 393 392 LYS D Protein S 3 FT #SUB 375 374 MET E 391 390 GLU D Protein A 4 FT #SUB 377 376 ALA E 495 494 ILE D Protein A 6 FT #SUB 380 379 ALA E 388 387 SER D Protein A 2 FT #SUB 380 379 ALA E 391 390 GLU D Protein A 4 FT #SUB 380 379 ALA E 495 494 ILE D Protein S 1 FT #SUB 383 382 SER E 387 386 ASN D Protein S 1 FT #SUB 383 382 SER E 391 390 GLU D Protein S 4 FT #SUB 384 383 SER E 384 383 SER D Protein A 8 FT #SUB 384 383 SER E 387 386 ASN D Protein S 1 FT #SUB 384 383 SER E 388 387 SER D Protein S 1 FT #SUB 387 386 ASN E 368 367 LYS D Protein S 1 FT #SUB 388 387 SER E 380 379 ALA D Protein S 2 FT #SUB 388 387 SER E 384 383 SER D Protein S 1 FT #SUB 390 389 TYR E 373 372 ILE D Protein B 1 FT #SUB 391 390 GLU E 368 367 LYS D Protein S 1 FT #SUB 391 390 GLU E 373 372 ILE D Protein A 10 FT #SUB 391 390 GLU E 374 373 PRO D Protein B 5 FT #SUB 391 390 GLU E 375 374 MET D Protein A 4 FT #SUB 391 390 GLU E 380 379 ALA D Protein S 2 FT #SUB 391 390 GLU E 383 382 SER D Protein S 3 FT #SUB 392 391 THR E 374 373 PRO D Protein B 5 FT #SUB 393 392 LYS E 373 372 ILE D Protein S 1 FT #SUB 393 392 LYS E 374 373 PRO D Protein S 1 FT #SUB 483 482 ASP E 494 493 ARG D Protein S 4 FT #SUB 484 483 HIS E 484 483 HIS D Protein S 4 FT #SUB 491 490 ASN E 493 492 THR D Protein B 1 FT #SUB 491 490 ASN E 494 493 ARG D Protein A 4 FT #SUB 491 490 ASN E 495 494 ILE D Protein B 1 FT #SUB 492 491 GLN E 492 491 GLN D Protein S 12 FT #SUB 492 491 GLN E 493 492 THR D Protein A 4 FT #SUB 493 492 THR E 491 490 ASN D Protein B 1 FT #SUB 493 492 THR E 492 491 GLN D Protein B 1 FT #SUB 493 492 THR E 493 492 THR D Protein A 3 FT #SUB 494 493 ARG E 483 482 ASP D Protein S 3 FT #SUB 494 493 ARG E 491 490 ASN D Protein A 3 FT #SUB 495 494 ILE E 377 376 ALA D Protein S 4 FT #SUB 495 494 ILE E 380 379 ALA D Protein S 1 FT #SUB 495 494 ILE E 491 490 ASN D Protein B 1 FT #SUB 4 3 LEU E 284 283 SER G Protein S 2 FT #SUB 4 3 LEU E 366 365 SER G Protein S 3 FT #SUB 4 3 LEU E 370 369 LEU G Protein S 1 FT #SUB 7 6 ASN E 280 279 LYS G Protein S 1 FT #SUB 7 6 ASN E 281 280 ILE G Protein B 1 FT #SUB 7 6 ASN E 284 283 SER G Protein S 2 FT #SUB 8 7 LEU E 285 284 LYS G Protein S 1 FT #SUB 10 9 LEU E 277 276 VAL G Protein S 1 FT #SUB 10 9 LEU E 281 280 ILE G Protein B 3 FT #SUB 12 11 ILE E 274 273 LYS G Protein A 6 FT #SUB 13 12 PHE E 243 242 HIS G Protein S 3 FT #SUB 243 242 HIS E 13 12 PHE G Protein S 8 FT #SUB 263 262 ARG E 311 310 ARG G Protein B 1 FT #SUB 264 263 GLY E 311 310 ARG G Protein B 1 FT #SUB 270 269 ILE E 12 11 ILE G Protein S 1 FT #SUB 273 272 GLU E 353 352 GLU G Protein A 14 FT #SUB 274 273 LYS E 12 11 ILE G Protein A 13 FT #SUB 274 273 LYS E 353 352 GLU G Protein S 2 FT #SUB 276 275 VAL E 322 321 PHE G Protein S 1 FT #SUB 277 276 VAL E 10 9 LEU G Protein S 1 FT #SUB 277 276 VAL E 11 10 SER G Protein S 2 FT #SUB 277 276 VAL E 353 352 GLU G Protein S 1 FT #SUB 280 279 LYS E 3 2 GLN G Protein S 2 FT #SUB 280 279 LYS E 7 6 ASN G Protein A 9 FT #SUB 281 280 ILE E 7 6 ASN G Protein A 5 FT #SUB 281 280 ILE E 10 9 LEU G Protein S 4 FT #SUB 284 283 SER E 4 3 LEU G Protein A 4 FT #SUB 284 283 SER E 7 6 ASN G Protein S 2 FT #SUB 285 284 LYS E 8 7 LEU G Protein S 1 FT #SUB 297 296 THR E 311 310 ARG G Protein B 2 FT #SUB 298 297 GLN E 311 310 ARG G Protein S 18 FT #SUB 298 297 GLN E 312 311 ALA G Protein B 2 FT #SUB 311 310 ARG E 263 262 ARG G Protein S 4 FT #SUB 311 310 ARG E 264 263 GLY G Protein S 2 FT #SUB 311 310 ARG E 297 296 THR G Protein S 2 FT #SUB 311 310 ARG E 298 297 GLN G Protein A 10 FT #SUB 312 311 ALA E 298 297 GLN G Protein S 1 FT #SUB 312 311 ALA E 312 311 ALA G Protein A 10 FT #SUB 312 311 ALA E 313 312 GLU G Protein S 3 FT #SUB 312 311 ALA E 316 315 ASP G Protein A 7 FT #SUB 313 312 GLU E 312 311 ALA G Protein A 4 FT #SUB 315 314 SER E 316 315 ASP G Protein S 2 FT #SUB 316 315 ASP E 312 311 ALA G Protein S 2 FT #SUB 316 315 ASP E 315 314 SER G Protein A 5 FT #SUB 319 318 ASN E 319 318 ASN G Protein S 12 FT #SUB 349 348 ARG E 273 272 GLU G Protein S 3 FT #SUB 353 352 GLU E 273 272 GLU G Protein S 5 FT #SUB 353 352 GLU E 274 273 LYS G Protein S 2 FT #SUB 353 352 GLU E 277 276 VAL G Protein S 1 FT #HET 400 399 LEU E 5 700 FDP E A 11 FT #HET 401 400 SER E 5 700 FDP E A 9 FT #HET 402 401 ASN E 5 700 FDP E A 12 FT #HET 403 402 THR E 5 700 FDP E A 11 FT #HET 405 404 ARG E 5 700 FDP E A 5 FT #HET 406 405 SER E 5 700 FDP E A 7 FT #HET 454 453 LYS E 5 700 FDP E S 8 FT #HET 457 456 ARG E 5 700 FDP E S 9 FT #HET 480 479 ILE E 5 700 FDP E B 1 FT #HET 481 480 HIS E 5 700 FDP E A 3 FT #HET 482 481 ALA E 5 700 FDP E A 4 FT #HET 487 486 LYS E 5 700 FDP E B 1 FT #HET 488 487 GLY E 5 700 FDP E B 1 FT #HET 489 488 TYR E 5 700 FDP E B 2 FT #HET 490 489 ALA E 5 700 FDP E S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQF STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 3 2 GLN F 280 279 LYS D Protein S 1 FT #SUB 4 3 LEU F 284 283 SER D Protein S 2 FT #SUB 4 3 LEU F 370 369 LEU D Protein S 1 FT #SUB 7 6 ASN F 280 279 LYS D Protein S 7 FT #SUB 7 6 ASN F 281 280 ILE D Protein B 2 FT #SUB 7 6 ASN F 284 283 SER D Protein S 1 FT #SUB 8 7 LEU F 285 284 LYS D Protein S 1 FT #SUB 10 9 LEU F 277 276 VAL D Protein S 1 FT #SUB 10 9 LEU F 281 280 ILE D Protein B 2 FT #SUB 12 11 ILE F 270 269 ILE D Protein S 1 FT #SUB 12 11 ILE F 274 273 LYS D Protein A 8 FT #SUB 13 12 PHE F 243 242 HIS D Protein S 5 FT #SUB 243 242 HIS F 13 12 PHE D Protein S 7 FT #SUB 263 262 ARG F 311 310 ARG D Protein A 2 FT #SUB 264 263 GLY F 311 310 ARG D Protein B 2 FT #SUB 270 269 ILE F 12 11 ILE D Protein S 1 FT #SUB 273 272 GLU F 353 352 GLU D Protein A 10 FT #SUB 274 273 LYS F 12 11 ILE D Protein A 12 FT #SUB 274 273 LYS F 353 352 GLU D Protein S 2 FT #SUB 277 276 VAL F 10 9 LEU D Protein S 1 FT #SUB 277 276 VAL F 353 352 GLU D Protein S 1 FT #SUB 280 279 LYS F 3 2 GLN D Protein S 1 FT #SUB 280 279 LYS F 7 6 ASN D Protein S 5 FT #SUB 281 280 ILE F 7 6 ASN D Protein S 1 FT #SUB 281 280 ILE F 10 9 LEU D Protein S 2 FT #SUB 284 283 SER F 4 3 LEU D Protein S 2 FT #SUB 284 283 SER F 7 6 ASN D Protein S 1 FT #SUB 285 284 LYS F 8 7 LEU D Protein S 1 FT #SUB 297 296 THR F 311 310 ARG D Protein B 2 FT #SUB 298 297 GLN F 311 310 ARG D Protein S 12 FT #SUB 298 297 GLN F 312 311 ALA D Protein B 1 FT #SUB 311 310 ARG F 263 262 ARG D Protein S 2 FT #SUB 311 310 ARG F 264 263 GLY D Protein S 1 FT #SUB 311 310 ARG F 297 296 THR D Protein S 2 FT #SUB 311 310 ARG F 298 297 GLN D Protein A 16 FT #SUB 312 311 ALA F 298 297 GLN D Protein A 2 FT #SUB 312 311 ALA F 312 311 ALA D Protein A 9 FT #SUB 312 311 ALA F 313 312 GLU D Protein S 3 FT #SUB 312 311 ALA F 316 315 ASP D Protein A 5 FT #SUB 313 312 GLU F 312 311 ALA D Protein A 3 FT #SUB 315 314 SER F 316 315 ASP D Protein S 2 FT #SUB 316 315 ASP F 312 311 ALA D Protein S 6 FT #SUB 316 315 ASP F 315 314 SER D Protein S 2 FT #SUB 319 318 ASN F 319 318 ASN D Protein S 9 FT #SUB 353 352 GLU F 273 272 GLU D Protein S 10 FT #SUB 353 352 GLU F 274 273 LYS D Protein S 2 FT #SUB 353 352 GLU F 277 276 VAL D Protein S 1 FT #SUB 366 365 SER F 4 3 LEU D Protein S 1 FT #SUB 370 369 LEU F 4 3 LEU D Protein S 1 FT #SUB 373 372 ILE F 390 389 TYR G Protein S 1 FT #SUB 373 372 ILE F 391 390 GLU G Protein A 15 FT #SUB 374 373 PRO F 391 390 GLU G Protein A 7 FT #SUB 374 373 PRO F 392 391 THR G Protein A 7 FT #SUB 374 373 PRO F 393 392 LYS G Protein S 2 FT #SUB 375 374 MET F 391 390 GLU G Protein A 5 FT #SUB 377 376 ALA F 495 494 ILE G Protein A 6 FT #SUB 380 379 ALA F 388 387 SER G Protein S 1 FT #SUB 380 379 ALA F 391 390 GLU G Protein A 2 FT #SUB 380 379 ALA F 495 494 ILE G Protein S 1 FT #SUB 383 382 SER F 391 390 GLU G Protein S 1 FT #SUB 384 383 SER F 384 383 SER G Protein A 6 FT #SUB 388 387 SER F 380 379 ALA G Protein S 1 FT #SUB 390 389 TYR F 373 372 ILE G Protein B 1 FT #SUB 391 390 GLU F 373 372 ILE G Protein A 9 FT #SUB 391 390 GLU F 374 373 PRO G Protein B 7 FT #SUB 391 390 GLU F 375 374 MET G Protein A 4 FT #SUB 391 390 GLU F 380 379 ALA G Protein S 2 FT #SUB 391 390 GLU F 383 382 SER G Protein S 1 FT #SUB 392 391 THR F 374 373 PRO G Protein B 6 FT #SUB 393 392 LYS F 374 373 PRO G Protein A 2 FT #SUB 483 482 ASP F 494 493 ARG G Protein S 4 FT #SUB 484 483 HIS F 484 483 HIS G Protein S 4 FT #SUB 491 490 ASN F 493 492 THR G Protein B 3 FT #SUB 491 490 ASN F 494 493 ARG G Protein A 4 FT #SUB 492 491 GLN F 492 491 GLN G Protein S 11 FT #SUB 492 491 GLN F 493 492 THR G Protein B 1 FT #SUB 493 492 THR F 491 490 ASN G Protein B 3 FT #SUB 493 492 THR F 492 491 GLN G Protein B 1 FT #SUB 494 493 ARG F 483 482 ASP G Protein S 5 FT #SUB 494 493 ARG F 491 490 ASN G Protein A 3 FT #SUB 495 494 ILE F 377 376 ALA G Protein S 6 FT #HET 400 399 LEU F 6 700 FDP F A 11 FT #HET 401 400 SER F 6 700 FDP F A 9 FT #HET 402 401 ASN F 6 700 FDP F A 12 FT #HET 403 402 THR F 6 700 FDP F A 11 FT #HET 405 404 ARG F 6 700 FDP F A 6 FT #HET 406 405 SER F 6 700 FDP F A 7 FT #HET 454 453 LYS F 6 700 FDP F S 8 FT #HET 457 456 ARG F 6 700 FDP F S 9 FT #HET 480 479 ILE F 6 700 FDP F B 1 FT #HET 481 480 HIS F 6 700 FDP F A 3 FT #HET 482 481 ALA F 6 700 FDP F A 4 FT #HET 487 486 LYS F 6 700 FDP F B 1 FT #HET 488 487 GLY F 6 700 FDP F B 1 FT #HET 489 488 TYR F 6 700 FDP F B 2 FT #HET 490 489 ALA F 6 700 FDP F S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQG STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 58 57 HIS G 103 102 GLU B Protein S 4 FT #SUB 59 58 GLU G 104 103 ARG B Protein S 6 FT #SUB 59 58 GLU G 169 168 SER B Protein S 5 FT #SUB 3 2 GLN G 280 279 LYS E Protein S 2 FT #SUB 4 3 LEU G 284 283 SER E Protein S 4 FT #SUB 7 6 ASN G 280 279 LYS E Protein S 9 FT #SUB 7 6 ASN G 281 280 ILE E Protein B 5 FT #SUB 7 6 ASN G 284 283 SER E Protein S 2 FT #SUB 8 7 LEU G 285 284 LYS E Protein S 1 FT #SUB 10 9 LEU G 277 276 VAL E Protein S 1 FT #SUB 10 9 LEU G 281 280 ILE E Protein A 4 FT #SUB 11 10 SER G 277 276 VAL E Protein B 2 FT #SUB 12 11 ILE G 270 269 ILE E Protein S 1 FT #SUB 12 11 ILE G 274 273 LYS E Protein A 13 FT #SUB 13 12 PHE G 243 242 HIS E Protein S 8 FT #SUB 243 242 HIS G 13 12 PHE E Protein S 3 FT #SUB 263 262 ARG G 311 310 ARG E Protein A 4 FT #SUB 264 263 GLY G 311 310 ARG E Protein B 2 FT #SUB 273 272 GLU G 349 348 ARG E Protein S 3 FT #SUB 273 272 GLU G 353 352 GLU E Protein A 5 FT #SUB 274 273 LYS G 12 11 ILE E Protein S 6 FT #SUB 274 273 LYS G 353 352 GLU E Protein S 2 FT #SUB 277 276 VAL G 10 9 LEU E Protein S 1 FT #SUB 277 276 VAL G 353 352 GLU E Protein S 1 FT #SUB 280 279 LYS G 7 6 ASN E Protein S 1 FT #SUB 281 280 ILE G 7 6 ASN E Protein S 1 FT #SUB 281 280 ILE G 10 9 LEU E Protein S 3 FT #SUB 284 283 SER G 4 3 LEU E Protein S 2 FT #SUB 284 283 SER G 7 6 ASN E Protein S 2 FT #SUB 285 284 LYS G 8 7 LEU E Protein S 1 FT #SUB 297 296 THR G 311 310 ARG E Protein B 2 FT #SUB 298 297 GLN G 311 310 ARG E Protein S 10 FT #SUB 298 297 GLN G 312 311 ALA E Protein B 1 FT #SUB 311 310 ARG G 263 262 ARG E Protein S 1 FT #SUB 311 310 ARG G 264 263 GLY E Protein S 1 FT #SUB 311 310 ARG G 297 296 THR E Protein S 2 FT #SUB 311 310 ARG G 298 297 GLN E Protein A 18 FT #SUB 312 311 ALA G 298 297 GLN E Protein A 2 FT #SUB 312 311 ALA G 312 311 ALA E Protein A 10 FT #SUB 312 311 ALA G 313 312 GLU E Protein S 4 FT #SUB 312 311 ALA G 316 315 ASP E Protein A 2 FT #SUB 313 312 GLU G 312 311 ALA E Protein A 3 FT #SUB 315 314 SER G 316 315 ASP E Protein S 5 FT #SUB 316 315 ASP G 312 311 ALA E Protein S 7 FT #SUB 316 315 ASP G 315 314 SER E Protein S 2 FT #SUB 319 318 ASN G 319 318 ASN E Protein S 12 FT #SUB 322 321 PHE G 276 275 VAL E Protein S 1 FT #SUB 353 352 GLU G 273 272 GLU E Protein S 14 FT #SUB 353 352 GLU G 274 273 LYS E Protein S 2 FT #SUB 353 352 GLU G 277 276 VAL E Protein S 1 FT #SUB 366 365 SER G 4 3 LEU E Protein A 3 FT #SUB 370 369 LEU G 4 3 LEU E Protein S 1 FT #SUB 373 372 ILE G 390 389 TYR F Protein S 1 FT #SUB 373 372 ILE G 391 390 GLU F Protein A 9 FT #SUB 374 373 PRO G 391 390 GLU F Protein A 7 FT #SUB 374 373 PRO G 392 391 THR F Protein S 6 FT #SUB 374 373 PRO G 393 392 LYS F Protein S 2 FT #SUB 375 374 MET G 391 390 GLU F Protein A 4 FT #SUB 377 376 ALA G 495 494 ILE F Protein A 6 FT #SUB 380 379 ALA G 388 387 SER F Protein S 1 FT #SUB 380 379 ALA G 391 390 GLU F Protein A 2 FT #SUB 383 382 SER G 391 390 GLU F Protein S 1 FT #SUB 384 383 SER G 384 383 SER F Protein A 6 FT #SUB 388 387 SER G 380 379 ALA F Protein S 1 FT #SUB 390 389 TYR G 373 372 ILE F Protein B 1 FT #SUB 391 390 GLU G 373 372 ILE F Protein A 15 FT #SUB 391 390 GLU G 374 373 PRO F Protein B 7 FT #SUB 391 390 GLU G 375 374 MET F Protein A 5 FT #SUB 391 390 GLU G 380 379 ALA F Protein S 2 FT #SUB 391 390 GLU G 383 382 SER F Protein S 1 FT #SUB 392 391 THR G 374 373 PRO F Protein B 7 FT #SUB 393 392 LYS G 374 373 PRO F Protein A 2 FT #SUB 483 482 ASP G 494 493 ARG F Protein S 5 FT #SUB 484 483 HIS G 484 483 HIS F Protein S 4 FT #SUB 491 490 ASN G 493 492 THR F Protein B 3 FT #SUB 491 490 ASN G 494 493 ARG F Protein A 3 FT #SUB 492 491 GLN G 492 491 GLN F Protein S 11 FT #SUB 492 491 GLN G 493 492 THR F Protein B 1 FT #SUB 493 492 THR G 491 490 ASN F Protein B 3 FT #SUB 493 492 THR G 492 491 GLN F Protein B 1 FT #SUB 494 493 ARG G 483 482 ASP F Protein S 4 FT #SUB 494 493 ARG G 491 490 ASN F Protein A 4 FT #SUB 495 494 ILE G 377 376 ALA F Protein S 6 FT #SUB 495 494 ILE G 380 379 ALA F Protein S 1 FT #HET 400 399 LEU G 7 700 FDP G A 12 FT #HET 401 400 SER G 7 700 FDP G A 10 FT #HET 402 401 ASN G 7 700 FDP G A 12 FT #HET 403 402 THR G 7 700 FDP G A 11 FT #HET 405 404 ARG G 7 700 FDP G A 4 FT #HET 406 405 SER G 7 700 FDP G A 7 FT #HET 454 453 LYS G 7 700 FDP G S 9 FT #HET 457 456 ARG G 7 700 FDP G S 11 FT #HET 480 479 ILE G 7 700 FDP G B 1 FT #HET 481 480 HIS G 7 700 FDP G A 4 FT #HET 482 481 ALA G 7 700 FDP G A 4 FT #HET 488 487 GLY G 7 700 FDP G B 1 FT #HET 490 489 ALA G 7 700 FDP G S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQH STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 373 372 ILE H 390 389 TYR I Protein S 1 FT #SUB 373 372 ILE H 391 390 GLU I Protein A 17 FT #SUB 374 373 PRO H 391 390 GLU I Protein A 5 FT #SUB 374 373 PRO H 392 391 THR I Protein S 3 FT #SUB 375 374 MET H 391 390 GLU I Protein A 5 FT #SUB 377 376 ALA H 495 494 ILE I Protein A 4 FT #SUB 380 379 ALA H 388 387 SER I Protein S 1 FT #SUB 380 379 ALA H 391 390 GLU I Protein A 2 FT #SUB 380 379 ALA H 495 494 ILE I Protein S 1 FT #SUB 384 383 SER H 384 383 SER I Protein A 5 FT #SUB 388 387 SER H 380 379 ALA I Protein S 1 FT #SUB 390 389 TYR H 373 372 ILE I Protein B 1 FT #SUB 391 390 GLU H 373 372 ILE I Protein A 9 FT #SUB 391 390 GLU H 374 373 PRO I Protein B 6 FT #SUB 391 390 GLU H 375 374 MET I Protein A 4 FT #SUB 391 390 GLU H 380 379 ALA I Protein S 3 FT #SUB 391 390 GLU H 383 382 SER I Protein S 1 FT #SUB 392 391 THR H 374 373 PRO I Protein B 4 FT #SUB 483 482 ASP H 494 493 ARG I Protein S 2 FT #SUB 484 483 HIS H 484 483 HIS I Protein S 4 FT #SUB 491 490 ASN H 493 492 THR I Protein B 1 FT #SUB 491 490 ASN H 494 493 ARG I Protein A 2 FT #SUB 492 491 GLN H 492 491 GLN I Protein S 9 FT #SUB 493 492 THR H 491 490 ASN I Protein B 3 FT #SUB 493 492 THR H 492 491 GLN I Protein B 1 FT #SUB 494 493 ARG H 483 482 ASP I Protein S 4 FT #SUB 494 493 ARG H 491 490 ASN I Protein A 3 FT #SUB 495 494 ILE H 377 376 ALA I Protein S 4 FT #SUB 3 2 GLN H 280 279 LYS J Protein S 2 FT #SUB 4 3 LEU H 284 283 SER J Protein S 2 FT #SUB 4 3 LEU H 366 365 SER J Protein S 1 FT #SUB 4 3 LEU H 370 369 LEU J Protein S 1 FT #SUB 7 6 ASN H 280 279 LYS J Protein S 8 FT #SUB 7 6 ASN H 281 280 ILE J Protein B 4 FT #SUB 7 6 ASN H 284 283 SER J Protein S 2 FT #SUB 8 7 LEU H 284 283 SER J Protein S 1 FT #SUB 8 7 LEU H 285 284 LYS J Protein S 1 FT #SUB 10 9 LEU H 277 276 VAL J Protein A 2 FT #SUB 10 9 LEU H 281 280 ILE J Protein A 4 FT #SUB 11 10 SER H 277 276 VAL J Protein B 4 FT #SUB 12 11 ILE H 270 269 ILE J Protein S 2 FT #SUB 12 11 ILE H 274 273 LYS J Protein A 20 FT #SUB 12 11 ILE H 277 276 VAL J Protein B 1 FT #SUB 12 11 ILE H 278 277 ALA J Protein S 3 FT #SUB 13 12 PHE H 243 242 HIS J Protein S 9 FT #SUB 243 242 HIS H 13 12 PHE J Protein S 9 FT #SUB 246 245 VAL H 12 11 ILE J Protein S 1 FT #SUB 263 262 ARG H 311 310 ARG J Protein A 6 FT #SUB 264 263 GLY H 311 310 ARG J Protein B 5 FT #SUB 270 269 ILE H 12 11 ILE J Protein S 1 FT #SUB 273 272 GLU H 349 348 ARG J Protein S 2 FT #SUB 273 272 GLU H 353 352 GLU J Protein A 16 FT #SUB 274 273 LYS H 12 11 ILE J Protein A 8 FT #SUB 274 273 LYS H 353 352 GLU J Protein S 1 FT #SUB 277 276 VAL H 10 9 LEU J Protein S 1 FT #SUB 277 276 VAL H 11 10 SER J Protein S 3 FT #SUB 277 276 VAL H 12 11 ILE J Protein S 1 FT #SUB 277 276 VAL H 353 352 GLU J Protein S 1 FT #SUB 278 277 ALA H 12 11 ILE J Protein A 3 FT #SUB 280 279 LYS H 7 6 ASN J Protein S 4 FT #SUB 281 280 ILE H 7 6 ASN J Protein S 1 FT #SUB 281 280 ILE H 10 9 LEU J Protein S 4 FT #SUB 284 283 SER H 4 3 LEU J Protein S 2 FT #SUB 284 283 SER H 7 6 ASN J Protein S 2 FT #SUB 285 284 LYS H 8 7 LEU J Protein S 1 FT #SUB 297 296 THR H 311 310 ARG J Protein B 3 FT #SUB 298 297 GLN H 309 308 PRO J Protein S 1 FT #SUB 298 297 GLN H 310 309 THR J Protein S 2 FT #SUB 298 297 GLN H 311 310 ARG J Protein A 21 FT #SUB 298 297 GLN H 312 311 ALA J Protein B 3 FT #SUB 299 298 MET H 312 311 ALA J Protein B 1 FT #SUB 310 309 THR H 313 312 GLU J Protein S 1 FT #SUB 311 310 ARG H 263 262 ARG J Protein S 3 FT #SUB 311 310 ARG H 264 263 GLY J Protein S 3 FT #SUB 311 310 ARG H 297 296 THR J Protein S 3 FT #SUB 311 310 ARG H 298 297 GLN J Protein A 21 FT #SUB 312 311 ALA H 298 297 GLN J Protein A 3 FT #SUB 312 311 ALA H 299 298 MET J Protein S 2 FT #SUB 312 311 ALA H 312 311 ALA J Protein A 12 FT #SUB 312 311 ALA H 313 312 GLU J Protein A 9 FT #SUB 312 311 ALA H 316 315 ASP J Protein A 9 FT #SUB 313 312 GLU H 310 309 THR J Protein S 1 FT #SUB 313 312 GLU H 312 311 ALA J Protein A 9 FT #SUB 315 314 SER H 316 315 ASP J Protein S 8 FT #SUB 316 315 ASP H 311 310 ARG J Protein S 3 FT #SUB 316 315 ASP H 312 311 ALA J Protein S 12 FT #SUB 316 315 ASP H 315 314 SER J Protein A 8 FT #SUB 319 318 ASN H 319 318 ASN J Protein S 15 FT #SUB 353 352 GLU H 273 272 GLU J Protein S 20 FT #SUB 353 352 GLU H 274 273 LYS J Protein S 4 FT #SUB 353 352 GLU H 277 276 VAL J Protein S 1 FT #SUB 366 365 SER H 4 3 LEU J Protein A 3 FT #SUB 370 369 LEU H 4 3 LEU J Protein S 1 FT #SUB 473 472 THR H 192 191 ALA M Protein B 1 FT #SUB 474 473 GLY H 192 191 ALA M Protein B 3 FT #SUB 497 496 LEU H 196 195 VAL M Protein S 8 FT #SUB 499 498 GLU H 58 57 HIS M Protein S 1 FT #SUB 499 498 GLU H 196 195 VAL M Protein S 1 FT #HET 400 399 LEU H 8 700 FDP H A 12 FT #HET 401 400 SER H 8 700 FDP H A 10 FT #HET 402 401 ASN H 8 700 FDP H A 12 FT #HET 403 402 THR H 8 700 FDP H A 11 FT #HET 405 404 ARG H 8 700 FDP H A 4 FT #HET 406 405 SER H 8 700 FDP H A 7 FT #HET 454 453 LYS H 8 700 FDP H S 9 FT #HET 457 456 ARG H 8 700 FDP H S 11 FT #HET 480 479 ILE H 8 700 FDP H B 1 FT #HET 481 480 HIS H 8 700 FDP H A 4 FT #HET 482 481 ALA H 8 700 FDP H A 4 FT #HET 488 487 GLY H 8 700 FDP H B 1 FT #HET 490 489 ALA H 8 700 FDP H S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQI STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 3 2 GLN I 280 279 LYS A Protein S 1 FT #SUB 4 3 LEU I 284 283 SER A Protein S 5 FT #SUB 4 3 LEU I 288 287 VAL A Protein S 1 FT #SUB 4 3 LEU I 370 369 LEU A Protein S 1 FT #SUB 7 6 ASN I 280 279 LYS A Protein S 2 FT #SUB 7 6 ASN I 281 280 ILE A Protein B 2 FT #SUB 7 6 ASN I 284 283 SER A Protein S 1 FT #SUB 8 7 LEU I 285 284 LYS A Protein S 2 FT #SUB 10 9 LEU I 281 280 ILE A Protein A 2 FT #SUB 12 11 ILE I 243 242 HIS A Protein S 2 FT #SUB 13 12 PHE I 243 242 HIS A Protein S 10 FT #SUB 243 242 HIS I 13 12 PHE A Protein S 4 FT #SUB 263 262 ARG I 311 310 ARG A Protein B 1 FT #SUB 264 263 GLY I 311 310 ARG A Protein B 2 FT #SUB 267 266 GLY I 311 310 ARG A Protein B 6 FT #SUB 268 267 VAL I 311 310 ARG A Protein A 2 FT #SUB 272 271 ALA I 314 313 VAL A Protein B 2 FT #SUB 273 272 GLU I 314 313 VAL A Protein B 2 FT #SUB 273 272 GLU I 350 349 ILE A Protein S 1 FT #SUB 273 272 GLU I 353 352 GLU A Protein A 3 FT #SUB 274 273 LYS I 12 11 ILE A Protein S 3 FT #SUB 274 273 LYS I 353 352 GLU A Protein S 3 FT #SUB 276 275 VAL I 315 314 SER A Protein S 1 FT #SUB 276 275 VAL I 322 321 PHE A Protein S 1 FT #SUB 277 276 VAL I 10 9 LEU A Protein S 2 FT #SUB 280 279 LYS I 3 2 GLN A Protein S 1 FT #SUB 280 279 LYS I 7 6 ASN A Protein S 4 FT #SUB 281 280 ILE I 7 6 ASN A Protein S 3 FT #SUB 284 283 SER I 4 3 LEU A Protein A 6 FT #SUB 284 283 SER I 7 6 ASN A Protein S 1 FT #SUB 285 284 LYS I 8 7 LEU A Protein S 3 FT #SUB 288 287 VAL I 4 3 LEU A Protein S 1 FT #SUB 298 297 GLN I 311 310 ARG A Protein S 5 FT #SUB 298 297 GLN I 312 311 ALA A Protein B 1 FT #SUB 310 309 THR I 298 297 GLN A Protein A 3 FT #SUB 311 310 ARG I 263 262 ARG A Protein S 3 FT #SUB 311 310 ARG I 264 263 GLY A Protein S 3 FT #SUB 311 310 ARG I 267 266 GLY A Protein S 5 FT #SUB 311 310 ARG I 268 267 VAL A Protein S 2 FT #SUB 311 310 ARG I 298 297 GLN A Protein A 3 FT #SUB 312 311 ALA I 298 297 GLN A Protein S 1 FT #SUB 314 313 VAL I 272 271 ALA A Protein S 3 FT #SUB 314 313 VAL I 273 272 GLU A Protein S 2 FT #SUB 315 314 SER I 276 275 VAL A Protein A 2 FT #SUB 315 314 SER I 316 315 ASP A Protein S 1 FT #SUB 316 315 ASP I 315 314 SER A Protein S 1 FT #SUB 318 317 ALA I 276 275 VAL A Protein S 2 FT #SUB 322 321 PHE I 276 275 VAL A Protein S 1 FT #SUB 349 348 ARG I 273 272 GLU A Protein S 3 FT #SUB 350 349 ILE I 273 272 GLU A Protein A 2 FT #SUB 353 352 GLU I 273 272 GLU A Protein S 3 FT #SUB 353 352 GLU I 274 273 LYS A Protein S 5 FT #SUB 370 369 LEU I 4 3 LEU A Protein S 1 FT #SUB 373 372 ILE I 390 389 TYR H Protein S 1 FT #SUB 373 372 ILE I 391 390 GLU H Protein A 9 FT #SUB 374 373 PRO I 391 390 GLU H Protein A 6 FT #SUB 374 373 PRO I 392 391 THR H Protein S 4 FT #SUB 375 374 MET I 391 390 GLU H Protein A 4 FT #SUB 377 376 ALA I 495 494 ILE H Protein A 4 FT #SUB 380 379 ALA I 388 387 SER H Protein S 1 FT #SUB 380 379 ALA I 391 390 GLU H Protein A 3 FT #SUB 383 382 SER I 391 390 GLU H Protein S 1 FT #SUB 384 383 SER I 384 383 SER H Protein S 5 FT #SUB 388 387 SER I 380 379 ALA H Protein S 1 FT #SUB 390 389 TYR I 373 372 ILE H Protein B 1 FT #SUB 391 390 GLU I 373 372 ILE H Protein A 17 FT #SUB 391 390 GLU I 374 373 PRO H Protein B 5 FT #SUB 391 390 GLU I 375 374 MET H Protein A 5 FT #SUB 391 390 GLU I 380 379 ALA H Protein S 2 FT #SUB 392 391 THR I 374 373 PRO H Protein B 3 FT #SUB 483 482 ASP I 494 493 ARG H Protein S 4 FT #SUB 484 483 HIS I 484 483 HIS H Protein S 4 FT #SUB 491 490 ASN I 493 492 THR H Protein B 3 FT #SUB 491 490 ASN I 494 493 ARG H Protein A 3 FT #SUB 492 491 GLN I 492 491 GLN H Protein S 9 FT #SUB 492 491 GLN I 493 492 THR H Protein B 1 FT #SUB 493 492 THR I 491 490 ASN H Protein B 1 FT #SUB 494 493 ARG I 483 482 ASP H Protein S 2 FT #SUB 494 493 ARG I 491 490 ASN H Protein A 2 FT #SUB 495 494 ILE I 377 376 ALA H Protein S 4 FT #SUB 495 494 ILE I 380 379 ALA H Protein S 1 FT #SUB 199 198 GLN I 487 486 LYS M Protein S 1 FT #SUB 229 228 PRO I 405 404 ARG M Protein S 4 FT #SUB 230 229 LYS I 487 486 LYS M Protein S 1 FT #SUB 230 229 LYS I 488 487 GLY M Protein S 14 FT #SUB 232 231 ARG I 232 231 ARG M Protein S 1 FT #SUB 405 404 ARG I 229 228 PRO M Protein S 9 FT #SUB 487 486 LYS I 199 198 GLN M Protein B 2 FT #SUB 487 486 LYS I 230 229 LYS M Protein B 1 FT #SUB 488 487 GLY I 230 229 LYS M Protein B 9 FT #SUB 58 57 HIS I 499 498 GLU N Protein S 1 FT #SUB 192 191 ALA I 473 472 THR N Protein S 1 FT #SUB 192 191 ALA I 474 473 GLY N Protein A 2 FT #SUB 196 195 VAL I 474 473 GLY N Protein S 2 FT #SUB 196 195 VAL I 497 496 LEU N Protein A 4 FT #SUB 196 195 VAL I 498 497 VAL N Protein S 1 FT #SUB 196 195 VAL I 499 498 GLU N Protein S 2 FT #HET 230 229 LYS I 13 700 FDP M S 1 FT #HET 400 399 LEU I 9 700 FDP I A 11 FT #HET 401 400 SER I 9 700 FDP I A 9 FT #HET 402 401 ASN I 9 700 FDP I A 12 FT #HET 403 402 THR I 9 700 FDP I A 11 FT #HET 405 404 ARG I 9 700 FDP I A 4 FT #HET 406 405 SER I 9 700 FDP I A 7 FT #HET 454 453 LYS I 9 700 FDP I S 8 FT #HET 457 456 ARG I 9 700 FDP I S 9 FT #HET 480 479 ILE I 9 700 FDP I B 1 FT #HET 481 480 HIS I 9 700 FDP I A 3 FT #HET 482 481 ALA I 9 700 FDP I A 4 FT #HET 487 486 LYS I 9 700 FDP I B 1 FT #HET 488 487 GLY I 9 700 FDP I B 1 FT #HET 489 488 TYR I 9 700 FDP I B 2 FT #HET 490 489 ALA I 9 700 FDP I S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQJ STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 368 367 LYS J 387 386 ASN A Protein S 1 FT #SUB 368 367 LYS J 391 390 GLU A Protein S 1 FT #SUB 373 372 ILE J 390 389 TYR A Protein S 2 FT #SUB 373 372 ILE J 391 390 GLU A Protein A 9 FT #SUB 373 372 ILE J 393 392 LYS A Protein A 2 FT #SUB 374 373 PRO J 391 390 GLU A Protein A 5 FT #SUB 374 373 PRO J 392 391 THR A Protein A 6 FT #SUB 374 373 PRO J 393 392 LYS A Protein A 4 FT #SUB 375 374 MET J 391 390 GLU A Protein A 5 FT #SUB 377 376 ALA J 495 494 ILE A Protein A 4 FT #SUB 380 379 ALA J 388 387 SER A Protein A 2 FT #SUB 380 379 ALA J 391 390 GLU A Protein A 2 FT #SUB 380 379 ALA J 495 494 ILE A Protein S 1 FT #SUB 383 382 SER J 391 390 GLU A Protein S 3 FT #SUB 384 383 SER J 384 383 SER A Protein A 6 FT #SUB 384 383 SER J 388 387 SER A Protein S 2 FT #SUB 387 386 ASN J 384 383 SER A Protein S 1 FT #SUB 388 387 SER J 384 383 SER A Protein S 1 FT #SUB 391 390 GLU J 373 372 ILE A Protein B 1 FT #SUB 391 390 GLU J 374 373 PRO A Protein B 2 FT #SUB 391 390 GLU J 380 379 ALA A Protein S 3 FT #SUB 391 390 GLU J 383 382 SER A Protein S 3 FT #SUB 483 482 ASP J 494 493 ARG A Protein S 3 FT #SUB 484 483 HIS J 484 483 HIS A Protein S 4 FT #SUB 491 490 ASN J 493 492 THR A Protein B 1 FT #SUB 491 490 ASN J 494 493 ARG A Protein B 2 FT #SUB 491 490 ASN J 495 494 ILE A Protein A 2 FT #SUB 492 491 GLN J 492 491 GLN A Protein S 8 FT #SUB 492 491 GLN J 493 492 THR A Protein B 1 FT #SUB 493 492 THR J 491 490 ASN A Protein B 1 FT #SUB 493 492 THR J 492 491 GLN A Protein B 2 FT #SUB 493 492 THR J 493 492 THR A Protein A 3 FT #SUB 494 493 ARG J 483 482 ASP A Protein S 2 FT #SUB 494 493 ARG J 491 490 ASN A Protein B 1 FT #SUB 495 494 ILE J 377 376 ALA A Protein S 1 FT #SUB 495 494 ILE J 491 490 ASN A Protein B 2 FT #SUB 4 3 LEU J 284 283 SER H Protein S 2 FT #SUB 4 3 LEU J 366 365 SER H Protein S 3 FT #SUB 4 3 LEU J 370 369 LEU H Protein S 1 FT #SUB 7 6 ASN J 280 279 LYS H Protein S 4 FT #SUB 7 6 ASN J 281 280 ILE H Protein B 1 FT #SUB 7 6 ASN J 284 283 SER H Protein S 2 FT #SUB 8 7 LEU J 285 284 LYS H Protein S 1 FT #SUB 10 9 LEU J 277 276 VAL H Protein S 1 FT #SUB 10 9 LEU J 281 280 ILE H Protein A 4 FT #SUB 11 10 SER J 277 276 VAL H Protein B 3 FT #SUB 12 11 ILE J 246 245 VAL H Protein S 1 FT #SUB 12 11 ILE J 270 269 ILE H Protein S 1 FT #SUB 12 11 ILE J 274 273 LYS H Protein A 8 FT #SUB 12 11 ILE J 277 276 VAL H Protein B 1 FT #SUB 12 11 ILE J 278 277 ALA H Protein S 3 FT #SUB 13 12 PHE J 243 242 HIS H Protein S 9 FT #SUB 243 242 HIS J 13 12 PHE H Protein S 9 FT #SUB 263 262 ARG J 311 310 ARG H Protein A 3 FT #SUB 264 263 GLY J 311 310 ARG H Protein B 3 FT #SUB 270 269 ILE J 12 11 ILE H Protein S 2 FT #SUB 273 272 GLU J 353 352 GLU H Protein A 20 FT #SUB 274 273 LYS J 12 11 ILE H Protein A 20 FT #SUB 274 273 LYS J 353 352 GLU H Protein A 4 FT #SUB 277 276 VAL J 10 9 LEU H Protein S 2 FT #SUB 277 276 VAL J 11 10 SER H Protein S 4 FT #SUB 277 276 VAL J 12 11 ILE H Protein S 1 FT #SUB 277 276 VAL J 353 352 GLU H Protein S 1 FT #SUB 278 277 ALA J 12 11 ILE H Protein A 3 FT #SUB 280 279 LYS J 3 2 GLN H Protein S 2 FT #SUB 280 279 LYS J 7 6 ASN H Protein S 8 FT #SUB 281 280 ILE J 7 6 ASN H Protein A 4 FT #SUB 281 280 ILE J 10 9 LEU H Protein S 4 FT #SUB 284 283 SER J 4 3 LEU H Protein S 2 FT #SUB 284 283 SER J 7 6 ASN H Protein S 2 FT #SUB 284 283 SER J 8 7 LEU H Protein S 1 FT #SUB 285 284 LYS J 8 7 LEU H Protein S 1 FT #SUB 297 296 THR J 311 310 ARG H Protein B 3 FT #SUB 298 297 GLN J 311 310 ARG H Protein A 21 FT #SUB 298 297 GLN J 312 311 ALA H Protein B 3 FT #SUB 299 298 MET J 312 311 ALA H Protein B 2 FT #SUB 309 308 PRO J 298 297 GLN H Protein B 1 FT #SUB 310 309 THR J 298 297 GLN H Protein A 2 FT #SUB 310 309 THR J 313 312 GLU H Protein S 1 FT #SUB 311 310 ARG J 263 262 ARG H Protein S 6 FT #SUB 311 310 ARG J 264 263 GLY H Protein S 5 FT #SUB 311 310 ARG J 297 296 THR H Protein S 3 FT #SUB 311 310 ARG J 298 297 GLN H Protein A 21 FT #SUB 311 310 ARG J 316 315 ASP H Protein B 3 FT #SUB 312 311 ALA J 298 297 GLN H Protein A 3 FT #SUB 312 311 ALA J 299 298 MET H Protein S 1 FT #SUB 312 311 ALA J 312 311 ALA H Protein A 12 FT #SUB 312 311 ALA J 313 312 GLU H Protein A 9 FT #SUB 312 311 ALA J 316 315 ASP H Protein A 12 FT #SUB 313 312 GLU J 310 309 THR H Protein S 1 FT #SUB 313 312 GLU J 312 311 ALA H Protein A 9 FT #SUB 315 314 SER J 316 315 ASP H Protein S 8 FT #SUB 316 315 ASP J 312 311 ALA H Protein S 9 FT #SUB 316 315 ASP J 315 314 SER H Protein A 8 FT #SUB 319 318 ASN J 319 318 ASN H Protein S 15 FT #SUB 349 348 ARG J 273 272 GLU H Protein S 2 FT #SUB 353 352 GLU J 273 272 GLU H Protein S 16 FT #SUB 353 352 GLU J 274 273 LYS H Protein S 1 FT #SUB 353 352 GLU J 277 276 VAL H Protein S 1 FT #SUB 366 365 SER J 4 3 LEU H Protein S 1 FT #SUB 370 369 LEU J 4 3 LEU H Protein S 1 FT #HET 400 399 LEU J 10 700 FDP J A 11 FT #HET 401 400 SER J 10 700 FDP J A 9 FT #HET 402 401 ASN J 10 700 FDP J A 12 FT #HET 403 402 THR J 10 700 FDP J A 11 FT #HET 405 404 ARG J 10 700 FDP J A 5 FT #HET 406 405 SER J 10 700 FDP J A 7 FT #HET 454 453 LYS J 10 700 FDP J S 8 FT #HET 457 456 ARG J 10 700 FDP J S 9 FT #HET 480 479 ILE J 10 700 FDP J B 1 FT #HET 481 480 HIS J 10 700 FDP J A 3 FT #HET 482 481 ALA J 10 700 FDP J A 4 FT #HET 487 486 LYS J 10 700 FDP J B 1 FT #HET 488 487 GLY J 10 700 FDP J B 1 FT #HET 489 488 TYR J 10 700 FDP J B 2 FT #HET 490 489 ALA J 10 700 FDP J S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQK STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 368 367 LYS K 368 367 LYS L Protein S 1 FT #SUB 373 372 ILE K 390 389 TYR L Protein S 1 FT #SUB 373 372 ILE K 391 390 GLU L Protein A 14 FT #SUB 374 373 PRO K 391 390 GLU L Protein A 6 FT #SUB 374 373 PRO K 392 391 THR L Protein S 5 FT #SUB 375 374 MET K 391 390 GLU L Protein A 4 FT #SUB 377 376 ALA K 495 494 ILE L Protein A 3 FT #SUB 380 379 ALA K 388 387 SER L Protein S 1 FT #SUB 380 379 ALA K 391 390 GLU L Protein A 2 FT #SUB 383 382 SER K 391 390 GLU L Protein S 1 FT #SUB 384 383 SER K 384 383 SER L Protein A 6 FT #SUB 388 387 SER K 380 379 ALA L Protein S 1 FT #SUB 390 389 TYR K 373 372 ILE L Protein B 2 FT #SUB 391 390 GLU K 373 372 ILE L Protein A 10 FT #SUB 391 390 GLU K 374 373 PRO L Protein B 5 FT #SUB 391 390 GLU K 375 374 MET L Protein A 5 FT #SUB 391 390 GLU K 380 379 ALA L Protein S 2 FT #SUB 391 390 GLU K 383 382 SER L Protein S 1 FT #SUB 392 391 THR K 374 373 PRO L Protein B 4 FT #SUB 393 392 LYS K 373 372 ILE L Protein S 2 FT #SUB 393 392 LYS K 374 373 PRO L Protein S 1 FT #SUB 483 482 ASP K 494 493 ARG L Protein S 2 FT #SUB 484 483 HIS K 484 483 HIS L Protein S 4 FT #SUB 491 490 ASN K 493 492 THR L Protein B 1 FT #SUB 491 490 ASN K 494 493 ARG L Protein B 1 FT #SUB 492 491 GLN K 492 491 GLN L Protein S 10 FT #SUB 492 491 GLN K 493 492 THR L Protein B 1 FT #SUB 493 492 THR K 491 490 ASN L Protein B 3 FT #SUB 493 492 THR K 492 491 GLN L Protein B 1 FT #SUB 494 493 ARG K 483 482 ASP L Protein S 5 FT #SUB 494 493 ARG K 491 490 ASN L Protein A 3 FT #SUB 495 494 ILE K 377 376 ALA L Protein S 6 FT #SUB 3 2 GLN K 280 279 LYS M Protein S 1 FT #SUB 4 3 LEU K 284 283 SER M Protein S 2 FT #SUB 4 3 LEU K 366 365 SER M Protein S 1 FT #SUB 4 3 LEU K 370 369 LEU M Protein S 1 FT #SUB 7 6 ASN K 280 279 LYS M Protein S 4 FT #SUB 7 6 ASN K 281 280 ILE M Protein B 1 FT #SUB 7 6 ASN K 284 283 SER M Protein S 2 FT #SUB 8 7 LEU K 285 284 LYS M Protein S 1 FT #SUB 10 9 LEU K 277 276 VAL M Protein S 1 FT #SUB 10 9 LEU K 281 280 ILE M Protein A 4 FT #SUB 11 10 SER K 277 276 VAL M Protein B 1 FT #SUB 12 11 ILE K 270 269 ILE M Protein S 1 FT #SUB 12 11 ILE K 274 273 LYS M Protein A 11 FT #SUB 12 11 ILE K 278 277 ALA M Protein S 1 FT #SUB 13 12 PHE K 243 242 HIS M Protein S 8 FT #SUB 243 242 HIS K 13 12 PHE M Protein S 9 FT #SUB 263 262 ARG K 311 310 ARG M Protein A 3 FT #SUB 264 263 GLY K 311 310 ARG M Protein B 3 FT #SUB 270 269 ILE K 12 11 ILE M Protein S 1 FT #SUB 273 272 GLU K 349 348 ARG M Protein S 2 FT #SUB 273 272 GLU K 353 352 GLU M Protein A 15 FT #SUB 274 273 LYS K 12 11 ILE M Protein A 9 FT #SUB 274 273 LYS K 353 352 GLU M Protein A 4 FT #SUB 276 275 VAL K 322 321 PHE M Protein S 1 FT #SUB 277 276 VAL K 10 9 LEU M Protein S 1 FT #SUB 277 276 VAL K 11 10 SER M Protein S 2 FT #SUB 277 276 VAL K 353 352 GLU M Protein S 1 FT #SUB 278 277 ALA K 12 11 ILE M Protein S 1 FT #SUB 280 279 LYS K 3 2 GLN M Protein S 2 FT #SUB 280 279 LYS K 7 6 ASN M Protein A 9 FT #SUB 281 280 ILE K 7 6 ASN M Protein A 5 FT #SUB 281 280 ILE K 10 9 LEU M Protein S 5 FT #SUB 284 283 SER K 4 3 LEU M Protein A 4 FT #SUB 284 283 SER K 7 6 ASN M Protein S 2 FT #SUB 285 284 LYS K 8 7 LEU M Protein S 1 FT #SUB 297 296 THR K 311 310 ARG M Protein B 2 FT #SUB 298 297 GLN K 310 309 THR M Protein S 4 FT #SUB 298 297 GLN K 311 310 ARG M Protein S 20 FT #SUB 298 297 GLN K 312 311 ALA M Protein B 2 FT #SUB 299 298 MET K 312 311 ALA M Protein B 1 FT #SUB 310 309 THR K 298 297 GLN M Protein B 2 FT #SUB 311 310 ARG K 263 262 ARG M Protein S 4 FT #SUB 311 310 ARG K 264 263 GLY M Protein S 4 FT #SUB 311 310 ARG K 297 296 THR M Protein S 2 FT #SUB 311 310 ARG K 298 297 GLN M Protein A 16 FT #SUB 312 311 ALA K 298 297 GLN M Protein A 2 FT #SUB 312 311 ALA K 299 298 MET M Protein S 1 FT #SUB 312 311 ALA K 312 311 ALA M Protein A 10 FT #SUB 312 311 ALA K 313 312 GLU M Protein S 4 FT #SUB 312 311 ALA K 316 315 ASP M Protein A 9 FT #SUB 313 312 GLU K 312 311 ALA M Protein A 4 FT #SUB 315 314 SER K 316 315 ASP M Protein S 5 FT #SUB 316 315 ASP K 312 311 ALA M Protein S 7 FT #SUB 316 315 ASP K 315 314 SER M Protein A 6 FT #SUB 319 318 ASN K 319 318 ASN M Protein S 15 FT #SUB 349 348 ARG K 273 272 GLU M Protein S 3 FT #SUB 353 352 GLU K 273 272 GLU M Protein S 11 FT #SUB 353 352 GLU K 274 273 LYS M Protein S 2 FT #SUB 353 352 GLU K 277 276 VAL M Protein S 1 FT #SUB 370 369 LEU K 4 3 LEU M Protein S 1 FT #SUB 473 472 THR K 192 191 ALA S Protein B 1 FT #SUB 474 473 GLY K 192 191 ALA S Protein B 2 FT #SUB 474 473 GLY K 196 195 VAL S Protein B 2 FT #SUB 497 496 LEU K 196 195 VAL S Protein S 6 FT #SUB 498 497 VAL K 196 195 VAL S Protein B 1 FT #SUB 499 498 GLU K 58 57 HIS S Protein S 1 FT #SUB 499 498 GLU K 196 195 VAL S Protein S 2 FT #HET 400 399 LEU K 11 700 FDP K A 12 FT #HET 401 400 SER K 11 700 FDP K A 10 FT #HET 402 401 ASN K 11 700 FDP K A 12 FT #HET 403 402 THR K 11 700 FDP K A 11 FT #HET 405 404 ARG K 11 700 FDP K A 4 FT #HET 406 405 SER K 11 700 FDP K A 7 FT #HET 454 453 LYS K 11 700 FDP K S 9 FT #HET 457 456 ARG K 11 700 FDP K S 11 FT #HET 480 479 ILE K 11 700 FDP K B 1 FT #HET 481 480 HIS K 11 700 FDP K A 4 FT #HET 482 481 ALA K 11 700 FDP K A 4 FT #HET 488 487 GLY K 11 700 FDP K B 1 FT #HET 490 489 ALA K 11 700 FDP K S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQL STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 368 367 LYS L 368 367 LYS K Protein S 1 FT #SUB 373 372 ILE L 390 389 TYR K Protein S 2 FT #SUB 373 372 ILE L 391 390 GLU K Protein A 10 FT #SUB 373 372 ILE L 393 392 LYS K Protein A 2 FT #SUB 374 373 PRO L 391 390 GLU K Protein A 5 FT #SUB 374 373 PRO L 392 391 THR K Protein S 4 FT #SUB 374 373 PRO L 393 392 LYS K Protein S 1 FT #SUB 375 374 MET L 391 390 GLU K Protein A 5 FT #SUB 377 376 ALA L 495 494 ILE K Protein A 6 FT #SUB 380 379 ALA L 388 387 SER K Protein S 1 FT #SUB 380 379 ALA L 391 390 GLU K Protein A 2 FT #SUB 383 382 SER L 391 390 GLU K Protein S 1 FT #SUB 384 383 SER L 384 383 SER K Protein A 6 FT #SUB 388 387 SER L 380 379 ALA K Protein S 1 FT #SUB 390 389 TYR L 373 372 ILE K Protein B 1 FT #SUB 391 390 GLU L 373 372 ILE K Protein A 14 FT #SUB 391 390 GLU L 374 373 PRO K Protein B 6 FT #SUB 391 390 GLU L 375 374 MET K Protein A 4 FT #SUB 391 390 GLU L 380 379 ALA K Protein S 2 FT #SUB 391 390 GLU L 383 382 SER K Protein S 1 FT #SUB 392 391 THR L 374 373 PRO K Protein B 5 FT #SUB 483 482 ASP L 494 493 ARG K Protein S 5 FT #SUB 484 483 HIS L 484 483 HIS K Protein S 4 FT #SUB 491 490 ASN L 493 492 THR K Protein B 3 FT #SUB 491 490 ASN L 494 493 ARG K Protein A 3 FT #SUB 492 491 GLN L 492 491 GLN K Protein S 10 FT #SUB 492 491 GLN L 493 492 THR K Protein B 1 FT #SUB 493 492 THR L 491 490 ASN K Protein B 1 FT #SUB 493 492 THR L 492 491 GLN K Protein B 1 FT #SUB 494 493 ARG L 483 482 ASP K Protein S 2 FT #SUB 494 493 ARG L 491 490 ASN K Protein B 1 FT #SUB 495 494 ILE L 377 376 ALA K Protein S 3 FT #SUB 3 2 GLN L 280 279 LYS N Protein S 1 FT #SUB 4 3 LEU L 284 283 SER N Protein S 4 FT #SUB 4 3 LEU L 288 287 VAL N Protein S 2 FT #SUB 4 3 LEU L 370 369 LEU N Protein S 1 FT #SUB 7 6 ASN L 280 279 LYS N Protein S 4 FT #SUB 7 6 ASN L 281 280 ILE N Protein B 6 FT #SUB 7 6 ASN L 284 283 SER N Protein S 4 FT #SUB 8 7 LEU L 285 284 LYS N Protein S 3 FT #SUB 10 9 LEU L 277 276 VAL N Protein S 1 FT #SUB 10 9 LEU L 281 280 ILE N Protein A 6 FT #SUB 12 11 ILE L 246 245 VAL N Protein S 1 FT #SUB 12 11 ILE L 270 269 ILE N Protein S 1 FT #SUB 12 11 ILE L 274 273 LYS N Protein A 10 FT #SUB 12 11 ILE L 278 277 ALA N Protein S 1 FT #SUB 13 12 PHE L 243 242 HIS N Protein S 11 FT #SUB 243 242 HIS L 13 12 PHE N Protein S 9 FT #SUB 263 262 ARG L 311 310 ARG N Protein B 2 FT #SUB 264 263 GLY L 311 310 ARG N Protein B 6 FT #SUB 270 269 ILE L 12 11 ILE N Protein S 4 FT #SUB 273 272 GLU L 353 352 GLU N Protein A 16 FT #SUB 274 273 LYS L 12 11 ILE N Protein A 16 FT #SUB 274 273 LYS L 353 352 GLU N Protein S 4 FT #SUB 276 275 VAL L 322 321 PHE N Protein S 2 FT #SUB 277 276 VAL L 10 9 LEU N Protein S 4 FT #SUB 277 276 VAL L 11 10 SER N Protein S 1 FT #SUB 280 279 LYS L 3 2 GLN N Protein S 2 FT #SUB 280 279 LYS L 7 6 ASN N Protein A 15 FT #SUB 281 280 ILE L 7 6 ASN N Protein A 6 FT #SUB 281 280 ILE L 8 7 LEU N Protein B 1 FT #SUB 281 280 ILE L 10 9 LEU N Protein S 6 FT #SUB 284 283 SER L 4 3 LEU N Protein A 10 FT #SUB 284 283 SER L 7 6 ASN N Protein S 2 FT #SUB 285 284 LYS L 8 7 LEU N Protein S 4 FT #SUB 288 287 VAL L 4 3 LEU N Protein S 1 FT #SUB 297 296 THR L 311 310 ARG N Protein B 2 FT #SUB 298 297 GLN L 310 309 THR N Protein S 5 FT #SUB 298 297 GLN L 311 310 ARG N Protein A 19 FT #SUB 298 297 GLN L 312 311 ALA N Protein B 3 FT #SUB 299 298 MET L 312 311 ALA N Protein B 1 FT #SUB 311 310 ARG L 263 262 ARG N Protein S 3 FT #SUB 311 310 ARG L 264 263 GLY N Protein S 2 FT #SUB 311 310 ARG L 297 296 THR N Protein S 2 FT #SUB 311 310 ARG L 298 297 GLN N Protein A 17 FT #SUB 312 311 ALA L 298 297 GLN N Protein A 2 FT #SUB 312 311 ALA L 299 298 MET N Protein S 1 FT #SUB 312 311 ALA L 312 311 ALA N Protein A 10 FT #SUB 312 311 ALA L 313 312 GLU N Protein S 4 FT #SUB 312 311 ALA L 316 315 ASP N Protein A 9 FT #SUB 313 312 GLU L 312 311 ALA N Protein A 4 FT #SUB 315 314 SER L 316 315 ASP N Protein S 3 FT #SUB 316 315 ASP L 312 311 ALA N Protein S 3 FT #SUB 316 315 ASP L 315 314 SER N Protein A 5 FT #SUB 318 317 ALA L 276 275 VAL N Protein S 1 FT #SUB 319 318 ASN L 319 318 ASN N Protein S 13 FT #SUB 322 321 PHE L 276 275 VAL N Protein S 1 FT #SUB 349 348 ARG L 273 272 GLU N Protein S 4 FT #SUB 353 352 GLU L 273 272 GLU N Protein S 11 FT #SUB 353 352 GLU L 274 273 LYS N Protein S 7 FT #SUB 353 352 GLU L 277 276 VAL N Protein S 1 FT #SUB 370 369 LEU L 4 3 LEU N Protein S 1 FT #SUB 338 337 LYS L 158 157 ASP O Protein S 1 FT #SUB 338 337 LYS L 159 158 GLU O Protein S 1 FT #SUB 339 338 TYR L 159 158 GLU O Protein S 5 FT #SUB 199 198 GLN L 487 486 LYS S Protein S 1 FT #SUB 229 228 PRO L 405 404 ARG S Protein S 3 FT #SUB 230 229 LYS L 488 487 GLY S Protein S 8 FT #SUB 232 231 ARG L 232 231 ARG S Protein S 3 FT #SUB 405 404 ARG L 229 228 PRO S Protein S 4 FT #SUB 487 486 LYS L 199 198 GLN S Protein B 1 FT #SUB 488 487 GLY L 230 229 LYS S Protein B 10 FT #SUB 192 191 ALA L 473 472 THR T Protein S 1 FT #SUB 192 191 ALA L 474 473 GLY T Protein S 1 FT #SUB 196 195 VAL L 497 496 LEU T Protein S 2 FT #SUB 196 195 VAL L 498 497 VAL T Protein S 1 FT #SUB 196 195 VAL L 499 498 GLU T Protein S 2 FT #HET 230 229 LYS L 19 700 FDP S S 2 FT #HET 400 399 LEU L 12 700 FDP L A 12 FT #HET 401 400 SER L 12 700 FDP L A 10 FT #HET 402 401 ASN L 12 700 FDP L A 12 FT #HET 403 402 THR L 12 700 FDP L A 11 FT #HET 405 404 ARG L 12 700 FDP L A 4 FT #HET 406 405 SER L 12 700 FDP L A 7 FT #HET 454 453 LYS L 12 700 FDP L S 9 FT #HET 457 456 ARG L 12 700 FDP L S 11 FT #HET 480 479 ILE L 12 700 FDP L B 1 FT #HET 481 480 HIS L 12 700 FDP L A 4 FT #HET 482 481 ALA L 12 700 FDP L A 4 FT #HET 488 487 GLY L 12 700 FDP L B 1 FT #HET 490 489 ALA L 12 700 FDP L S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQM STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 58 57 HIS M 499 498 GLU H Protein S 1 FT #SUB 192 191 ALA M 473 472 THR H Protein S 1 FT #SUB 192 191 ALA M 474 473 GLY H Protein A 3 FT #SUB 196 195 VAL M 497 496 LEU H Protein A 8 FT #SUB 196 195 VAL M 499 498 GLU H Protein S 1 FT #SUB 199 198 GLN M 487 486 LYS I Protein S 2 FT #SUB 229 228 PRO M 405 404 ARG I Protein S 9 FT #SUB 230 229 LYS M 487 486 LYS I Protein S 1 FT #SUB 230 229 LYS M 488 487 GLY I Protein S 9 FT #SUB 232 231 ARG M 232 231 ARG I Protein S 1 FT #SUB 405 404 ARG M 229 228 PRO I Protein S 4 FT #SUB 487 486 LYS M 199 198 GLN I Protein B 1 FT #SUB 487 486 LYS M 230 229 LYS I Protein B 1 FT #SUB 488 487 GLY M 230 229 LYS I Protein B 14 FT #SUB 3 2 GLN M 280 279 LYS K Protein S 2 FT #SUB 4 3 LEU M 284 283 SER K Protein S 4 FT #SUB 4 3 LEU M 370 369 LEU K Protein S 1 FT #SUB 7 6 ASN M 280 279 LYS K Protein S 9 FT #SUB 7 6 ASN M 281 280 ILE K Protein B 5 FT #SUB 7 6 ASN M 284 283 SER K Protein S 2 FT #SUB 8 7 LEU M 285 284 LYS K Protein S 1 FT #SUB 10 9 LEU M 277 276 VAL K Protein S 1 FT #SUB 10 9 LEU M 281 280 ILE K Protein A 5 FT #SUB 11 10 SER M 277 276 VAL K Protein B 2 FT #SUB 12 11 ILE M 270 269 ILE K Protein S 1 FT #SUB 12 11 ILE M 274 273 LYS K Protein A 9 FT #SUB 12 11 ILE M 278 277 ALA K Protein S 1 FT #SUB 13 12 PHE M 243 242 HIS K Protein S 9 FT #SUB 243 242 HIS M 13 12 PHE K Protein S 8 FT #SUB 263 262 ARG M 311 310 ARG K Protein A 4 FT #SUB 264 263 GLY M 311 310 ARG K Protein B 4 FT #SUB 270 269 ILE M 12 11 ILE K Protein S 1 FT #SUB 273 272 GLU M 349 348 ARG K Protein S 3 FT #SUB 273 272 GLU M 353 352 GLU K Protein A 11 FT #SUB 274 273 LYS M 12 11 ILE K Protein A 11 FT #SUB 274 273 LYS M 353 352 GLU K Protein S 2 FT #SUB 277 276 VAL M 10 9 LEU K Protein S 1 FT #SUB 277 276 VAL M 11 10 SER K Protein S 1 FT #SUB 277 276 VAL M 353 352 GLU K Protein S 1 FT #SUB 278 277 ALA M 12 11 ILE K Protein S 1 FT #SUB 280 279 LYS M 3 2 GLN K Protein S 1 FT #SUB 280 279 LYS M 7 6 ASN K Protein S 4 FT #SUB 281 280 ILE M 7 6 ASN K Protein S 1 FT #SUB 281 280 ILE M 10 9 LEU K Protein S 4 FT #SUB 284 283 SER M 4 3 LEU K Protein S 2 FT #SUB 284 283 SER M 7 6 ASN K Protein S 2 FT #SUB 285 284 LYS M 8 7 LEU K Protein S 1 FT #SUB 297 296 THR M 311 310 ARG K Protein B 2 FT #SUB 298 297 GLN M 310 309 THR K Protein S 2 FT #SUB 298 297 GLN M 311 310 ARG K Protein S 16 FT #SUB 298 297 GLN M 312 311 ALA K Protein B 2 FT #SUB 299 298 MET M 312 311 ALA K Protein B 1 FT #SUB 310 309 THR M 298 297 GLN K Protein B 4 FT #SUB 311 310 ARG M 263 262 ARG K Protein S 3 FT #SUB 311 310 ARG M 264 263 GLY K Protein S 3 FT #SUB 311 310 ARG M 297 296 THR K Protein S 2 FT #SUB 311 310 ARG M 298 297 GLN K Protein A 20 FT #SUB 312 311 ALA M 298 297 GLN K Protein A 2 FT #SUB 312 311 ALA M 299 298 MET K Protein S 1 FT #SUB 312 311 ALA M 312 311 ALA K Protein A 10 FT #SUB 312 311 ALA M 313 312 GLU K Protein S 4 FT #SUB 312 311 ALA M 316 315 ASP K Protein A 7 FT #SUB 313 312 GLU M 312 311 ALA K Protein A 4 FT #SUB 315 314 SER M 316 315 ASP K Protein S 6 FT #SUB 316 315 ASP M 312 311 ALA K Protein S 9 FT #SUB 316 315 ASP M 315 314 SER K Protein A 5 FT #SUB 319 318 ASN M 319 318 ASN K Protein S 15 FT #SUB 322 321 PHE M 276 275 VAL K Protein S 1 FT #SUB 349 348 ARG M 273 272 GLU K Protein S 2 FT #SUB 353 352 GLU M 273 272 GLU K Protein S 15 FT #SUB 353 352 GLU M 274 273 LYS K Protein S 4 FT #SUB 353 352 GLU M 277 276 VAL K Protein S 1 FT #SUB 366 365 SER M 4 3 LEU K Protein S 1 FT #SUB 370 369 LEU M 4 3 LEU K Protein S 1 FT #SUB 373 372 ILE M 390 389 TYR N Protein S 1 FT #SUB 373 372 ILE M 391 390 GLU N Protein A 15 FT #SUB 374 373 PRO M 391 390 GLU N Protein A 6 FT #SUB 374 373 PRO M 392 391 THR N Protein A 5 FT #SUB 375 374 MET M 391 390 GLU N Protein A 5 FT #SUB 377 376 ALA M 495 494 ILE N Protein A 6 FT #SUB 380 379 ALA M 388 387 SER N Protein S 1 FT #SUB 380 379 ALA M 391 390 GLU N Protein A 2 FT #SUB 380 379 ALA M 495 494 ILE N Protein S 1 FT #SUB 383 382 SER M 391 390 GLU N Protein S 1 FT #SUB 384 383 SER M 384 383 SER N Protein A 7 FT #SUB 388 387 SER M 380 379 ALA N Protein S 1 FT #SUB 390 389 TYR M 373 372 ILE N Protein B 1 FT #SUB 391 390 GLU M 373 372 ILE N Protein A 4 FT #SUB 391 390 GLU M 374 373 PRO N Protein B 7 FT #SUB 391 390 GLU M 375 374 MET N Protein A 4 FT #SUB 391 390 GLU M 380 379 ALA N Protein S 3 FT #SUB 391 390 GLU M 383 382 SER N Protein S 1 FT #SUB 392 391 THR M 374 373 PRO N Protein B 5 FT #SUB 393 392 LYS M 374 373 PRO N Protein S 1 FT #SUB 483 482 ASP M 494 493 ARG N Protein S 3 FT #SUB 484 483 HIS M 484 483 HIS N Protein S 4 FT #SUB 491 490 ASN M 493 492 THR N Protein B 3 FT #SUB 491 490 ASN M 494 493 ARG N Protein A 5 FT #SUB 492 491 GLN M 492 491 GLN N Protein S 10 FT #SUB 492 491 GLN M 493 492 THR N Protein B 1 FT #SUB 493 492 THR M 491 490 ASN N Protein B 3 FT #SUB 493 492 THR M 492 491 GLN N Protein B 1 FT #SUB 494 493 ARG M 483 482 ASP N Protein S 6 FT #SUB 494 493 ARG M 491 490 ASN N Protein A 3 FT #SUB 495 494 ILE M 377 376 ALA N Protein S 5 FT #HET 230 229 LYS M 9 700 FDP I S 3 FT #HET 400 399 LEU M 13 700 FDP M A 12 FT #HET 401 400 SER M 13 700 FDP M A 10 FT #HET 402 401 ASN M 13 700 FDP M A 12 FT #HET 403 402 THR M 13 700 FDP M A 11 FT #HET 405 404 ARG M 13 700 FDP M A 4 FT #HET 406 405 SER M 13 700 FDP M A 7 FT #HET 454 453 LYS M 13 700 FDP M S 9 FT #HET 457 456 ARG M 13 700 FDP M S 11 FT #HET 480 479 ILE M 13 700 FDP M B 1 FT #HET 481 480 HIS M 13 700 FDP M A 4 FT #HET 482 481 ALA M 13 700 FDP M A 4 FT #HET 488 487 GLY M 13 700 FDP M B 1 FT #HET 490 489 ALA M 13 700 FDP M S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQN STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 447 446 LYS N 217 216 ALA C Protein A 10 FT #SUB 447 446 LYS N 218 217 GLU C Protein B 1 FT #SUB 447 446 LYS N 251 250 SER C Protein A 12 FT #SUB 447 446 LYS N 255 254 GLU C Protein S 6 FT #SUB 448 447 LEU N 218 217 GLU C Protein B 4 FT #SUB 449 448 GLY N 218 217 GLU C Protein B 3 FT #SUB 473 472 THR N 192 191 ALA I Protein B 1 FT #SUB 474 473 GLY N 192 191 ALA I Protein B 2 FT #SUB 474 473 GLY N 196 195 VAL I Protein B 2 FT #SUB 497 496 LEU N 196 195 VAL I Protein S 4 FT #SUB 498 497 VAL N 196 195 VAL I Protein B 1 FT #SUB 499 498 GLU N 58 57 HIS I Protein S 1 FT #SUB 499 498 GLU N 196 195 VAL I Protein S 2 FT #SUB 3 2 GLN N 280 279 LYS L Protein S 2 FT #SUB 4 3 LEU N 284 283 SER L Protein A 10 FT #SUB 4 3 LEU N 288 287 VAL L Protein S 1 FT #SUB 4 3 LEU N 370 369 LEU L Protein S 1 FT #SUB 7 6 ASN N 280 279 LYS L Protein S 15 FT #SUB 7 6 ASN N 281 280 ILE L Protein B 6 FT #SUB 7 6 ASN N 284 283 SER L Protein S 2 FT #SUB 8 7 LEU N 281 280 ILE L Protein S 1 FT #SUB 8 7 LEU N 285 284 LYS L Protein S 4 FT #SUB 10 9 LEU N 277 276 VAL L Protein A 4 FT #SUB 10 9 LEU N 281 280 ILE L Protein A 6 FT #SUB 11 10 SER N 277 276 VAL L Protein B 1 FT #SUB 12 11 ILE N 270 269 ILE L Protein S 4 FT #SUB 12 11 ILE N 274 273 LYS L Protein A 16 FT #SUB 13 12 PHE N 243 242 HIS L Protein S 9 FT #SUB 243 242 HIS N 13 12 PHE L Protein S 11 FT #SUB 246 245 VAL N 12 11 ILE L Protein S 1 FT #SUB 263 262 ARG N 311 310 ARG L Protein A 3 FT #SUB 264 263 GLY N 311 310 ARG L Protein B 2 FT #SUB 270 269 ILE N 12 11 ILE L Protein S 1 FT #SUB 273 272 GLU N 349 348 ARG L Protein S 4 FT #SUB 273 272 GLU N 353 352 GLU L Protein A 11 FT #SUB 274 273 LYS N 12 11 ILE L Protein S 10 FT #SUB 274 273 LYS N 353 352 GLU L Protein S 7 FT #SUB 276 275 VAL N 318 317 ALA L Protein S 1 FT #SUB 276 275 VAL N 322 321 PHE L Protein S 1 FT #SUB 277 276 VAL N 10 9 LEU L Protein S 1 FT #SUB 277 276 VAL N 353 352 GLU L Protein S 1 FT #SUB 278 277 ALA N 12 11 ILE L Protein S 1 FT #SUB 280 279 LYS N 3 2 GLN L Protein S 1 FT #SUB 280 279 LYS N 7 6 ASN L Protein A 4 FT #SUB 281 280 ILE N 7 6 ASN L Protein A 6 FT #SUB 281 280 ILE N 10 9 LEU L Protein S 6 FT #SUB 284 283 SER N 4 3 LEU L Protein A 4 FT #SUB 284 283 SER N 7 6 ASN L Protein S 4 FT #SUB 285 284 LYS N 8 7 LEU L Protein A 3 FT #SUB 288 287 VAL N 4 3 LEU L Protein S 2 FT #SUB 297 296 THR N 311 310 ARG L Protein B 2 FT #SUB 298 297 GLN N 311 310 ARG L Protein S 17 FT #SUB 298 297 GLN N 312 311 ALA L Protein B 2 FT #SUB 299 298 MET N 312 311 ALA L Protein B 1 FT #SUB 310 309 THR N 298 297 GLN L Protein A 5 FT #SUB 311 310 ARG N 263 262 ARG L Protein S 2 FT #SUB 311 310 ARG N 264 263 GLY L Protein S 6 FT #SUB 311 310 ARG N 297 296 THR L Protein S 2 FT #SUB 311 310 ARG N 298 297 GLN L Protein A 19 FT #SUB 312 311 ALA N 298 297 GLN L Protein A 3 FT #SUB 312 311 ALA N 299 298 MET L Protein S 1 FT #SUB 312 311 ALA N 312 311 ALA L Protein A 10 FT #SUB 312 311 ALA N 313 312 GLU L Protein S 4 FT #SUB 312 311 ALA N 316 315 ASP L Protein A 3 FT #SUB 313 312 GLU N 312 311 ALA L Protein A 4 FT #SUB 315 314 SER N 316 315 ASP L Protein S 5 FT #SUB 316 315 ASP N 312 311 ALA L Protein S 9 FT #SUB 316 315 ASP N 315 314 SER L Protein A 3 FT #SUB 319 318 ASN N 319 318 ASN L Protein S 13 FT #SUB 322 321 PHE N 276 275 VAL L Protein S 2 FT #SUB 353 352 GLU N 273 272 GLU L Protein S 16 FT #SUB 353 352 GLU N 274 273 LYS L Protein S 4 FT #SUB 370 369 LEU N 4 3 LEU L Protein S 1 FT #SUB 373 372 ILE N 390 389 TYR M Protein S 1 FT #SUB 373 372 ILE N 391 390 GLU M Protein S 4 FT #SUB 374 373 PRO N 391 390 GLU M Protein A 7 FT #SUB 374 373 PRO N 392 391 THR M Protein S 5 FT #SUB 374 373 PRO N 393 392 LYS M Protein S 1 FT #SUB 375 374 MET N 391 390 GLU M Protein A 4 FT #SUB 377 376 ALA N 495 494 ILE M Protein A 5 FT #SUB 380 379 ALA N 388 387 SER M Protein S 1 FT #SUB 380 379 ALA N 391 390 GLU M Protein A 3 FT #SUB 383 382 SER N 391 390 GLU M Protein S 1 FT #SUB 384 383 SER N 384 383 SER M Protein A 7 FT #SUB 388 387 SER N 380 379 ALA M Protein S 1 FT #SUB 390 389 TYR N 373 372 ILE M Protein B 1 FT #SUB 391 390 GLU N 373 372 ILE M Protein A 15 FT #SUB 391 390 GLU N 374 373 PRO M Protein B 6 FT #SUB 391 390 GLU N 375 374 MET M Protein A 5 FT #SUB 391 390 GLU N 380 379 ALA M Protein S 2 FT #SUB 391 390 GLU N 383 382 SER M Protein S 1 FT #SUB 392 391 THR N 374 373 PRO M Protein B 5 FT #SUB 483 482 ASP N 494 493 ARG M Protein S 6 FT #SUB 484 483 HIS N 484 483 HIS M Protein S 4 FT #SUB 491 490 ASN N 493 492 THR M Protein B 3 FT #SUB 491 490 ASN N 494 493 ARG M Protein A 3 FT #SUB 492 491 GLN N 492 491 GLN M Protein S 10 FT #SUB 492 491 GLN N 493 492 THR M Protein B 1 FT #SUB 493 492 THR N 491 490 ASN M Protein B 3 FT #SUB 493 492 THR N 492 491 GLN M Protein B 1 FT #SUB 494 493 ARG N 483 482 ASP M Protein S 3 FT #SUB 494 493 ARG N 491 490 ASN M Protein A 5 FT #SUB 495 494 ILE N 377 376 ALA M Protein S 6 FT #SUB 495 494 ILE N 380 379 ALA M Protein S 1 FT #SUB 305 304 TYR N 137 136 ARG O Protein S 11 FT #SUB 306 305 ASN N 137 136 ARG O Protein S 3 FT #HET 400 399 LEU N 14 700 FDP N A 11 FT #HET 401 400 SER N 14 700 FDP N A 9 FT #HET 402 401 ASN N 14 700 FDP N A 12 FT #HET 403 402 THR N 14 700 FDP N A 11 FT #HET 405 404 ARG N 14 700 FDP N A 5 FT #HET 406 405 SER N 14 700 FDP N A 7 FT #HET 454 453 LYS N 14 700 FDP N S 8 FT #HET 457 456 ARG N 14 700 FDP N S 9 FT #HET 480 479 ILE N 14 700 FDP N B 1 FT #HET 481 480 HIS N 14 700 FDP N A 3 FT #HET 482 481 ALA N 14 700 FDP N A 4 FT #HET 487 486 LYS N 14 700 FDP N B 1 FT #HET 488 487 GLY N 14 700 FDP N B 1 FT #HET 489 488 TYR N 14 700 FDP N B 2 FT #HET 490 489 ALA N 14 700 FDP N S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQO STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 373 372 ILE O 391 390 GLU B Protein S 3 FT #SUB 374 373 PRO O 391 390 GLU B Protein A 3 FT #SUB 374 373 PRO O 392 391 THR B Protein S 3 FT #SUB 375 374 MET O 391 390 GLU B Protein A 2 FT #SUB 377 376 ALA O 495 494 ILE B Protein B 1 FT #SUB 380 379 ALA O 391 390 GLU B Protein A 3 FT #SUB 383 382 SER O 391 390 GLU B Protein S 3 FT #SUB 384 383 SER O 384 383 SER B Protein A 7 FT #SUB 384 383 SER O 387 386 ASN B Protein S 1 FT #SUB 387 386 ASN O 368 367 LYS B Protein S 1 FT #SUB 388 387 SER O 380 379 ALA B Protein S 2 FT #SUB 388 387 SER O 384 383 SER B Protein S 2 FT #SUB 390 389 TYR O 373 372 ILE B Protein B 2 FT #SUB 391 390 GLU O 368 367 LYS B Protein S 1 FT #SUB 391 390 GLU O 373 372 ILE B Protein A 10 FT #SUB 391 390 GLU O 374 373 PRO B Protein B 5 FT #SUB 391 390 GLU O 375 374 MET B Protein A 5 FT #SUB 391 390 GLU O 380 379 ALA B Protein S 2 FT #SUB 391 390 GLU O 383 382 SER B Protein S 3 FT #SUB 392 391 THR O 374 373 PRO B Protein B 7 FT #SUB 393 392 LYS O 373 372 ILE B Protein S 2 FT #SUB 393 392 LYS O 374 373 PRO B Protein A 3 FT #SUB 483 482 ASP O 494 493 ARG B Protein S 2 FT #SUB 484 483 HIS O 484 483 HIS B Protein S 4 FT #SUB 491 490 ASN O 493 492 THR B Protein B 1 FT #SUB 491 490 ASN O 494 493 ARG B Protein B 1 FT #SUB 491 490 ASN O 495 494 ILE B Protein B 1 FT #SUB 492 491 GLN O 492 491 GLN B Protein S 8 FT #SUB 492 491 GLN O 493 492 THR B Protein B 1 FT #SUB 493 492 THR O 491 490 ASN B Protein B 1 FT #SUB 493 492 THR O 492 491 GLN B Protein B 1 FT #SUB 493 492 THR O 493 492 THR B Protein A 3 FT #SUB 494 493 ARG O 483 482 ASP B Protein S 3 FT #SUB 494 493 ARG O 491 490 ASN B Protein A 2 FT #SUB 495 494 ILE O 377 376 ALA B Protein S 4 FT #SUB 495 494 ILE O 380 379 ALA B Protein S 1 FT #SUB 495 494 ILE O 491 490 ASN B Protein B 1 FT #SUB 158 157 ASP O 338 337 LYS L Protein S 1 FT #SUB 159 158 GLU O 338 337 LYS L Protein B 1 FT #SUB 159 158 GLU O 339 338 TYR L Protein S 5 FT #SUB 137 136 ARG O 305 304 TYR N Protein S 11 FT #SUB 137 136 ARG O 306 305 ASN N Protein S 3 FT #SUB 3 2 GLN O 280 279 LYS P Protein S 2 FT #SUB 4 3 LEU O 284 283 SER P Protein S 2 FT #SUB 4 3 LEU O 366 365 SER P Protein S 1 FT #SUB 7 6 ASN O 280 279 LYS P Protein S 8 FT #SUB 7 6 ASN O 281 280 ILE P Protein B 1 FT #SUB 7 6 ASN O 284 283 SER P Protein S 1 FT #SUB 8 7 LEU O 284 283 SER P Protein S 1 FT #SUB 8 7 LEU O 285 284 LYS P Protein S 1 FT #SUB 10 9 LEU O 277 276 VAL P Protein A 2 FT #SUB 10 9 LEU O 281 280 ILE P Protein B 3 FT #SUB 11 10 SER O 277 276 VAL P Protein B 3 FT #SUB 12 11 ILE O 270 269 ILE P Protein S 1 FT #SUB 12 11 ILE O 274 273 LYS P Protein A 17 FT #SUB 12 11 ILE O 277 276 VAL P Protein B 1 FT #SUB 12 11 ILE O 278 277 ALA P Protein S 2 FT #SUB 13 12 PHE O 243 242 HIS P Protein S 7 FT #SUB 243 242 HIS O 13 12 PHE P Protein S 7 FT #SUB 246 245 VAL O 12 11 ILE P Protein S 1 FT #SUB 263 262 ARG O 311 310 ARG P Protein A 7 FT #SUB 264 263 GLY O 311 310 ARG P Protein B 4 FT #SUB 273 272 GLU O 349 348 ARG P Protein S 3 FT #SUB 273 272 GLU O 353 352 GLU P Protein A 10 FT #SUB 274 273 LYS O 12 11 ILE P Protein A 4 FT #SUB 274 273 LYS O 353 352 GLU P Protein S 1 FT #SUB 277 276 VAL O 10 9 LEU P Protein S 1 FT #SUB 277 276 VAL O 11 10 SER P Protein S 2 FT #SUB 277 276 VAL O 12 11 ILE P Protein S 1 FT #SUB 277 276 VAL O 353 352 GLU P Protein S 1 FT #SUB 278 277 ALA O 12 11 ILE P Protein A 3 FT #SUB 280 279 LYS O 7 6 ASN P Protein S 4 FT #SUB 281 280 ILE O 7 6 ASN P Protein S 1 FT #SUB 281 280 ILE O 10 9 LEU P Protein S 3 FT #SUB 284 283 SER O 4 3 LEU P Protein S 2 FT #SUB 284 283 SER O 7 6 ASN P Protein S 2 FT #SUB 297 296 THR O 311 310 ARG P Protein B 2 FT #SUB 298 297 GLN O 310 309 THR P Protein S 1 FT #SUB 298 297 GLN O 311 310 ARG P Protein S 13 FT #SUB 298 297 GLN O 312 311 ALA P Protein B 2 FT #SUB 299 298 MET O 312 311 ALA P Protein B 1 FT #SUB 310 309 THR O 298 297 GLN P Protein B 1 FT #SUB 311 310 ARG O 263 262 ARG P Protein S 2 FT #SUB 311 310 ARG O 264 263 GLY P Protein S 2 FT #SUB 311 310 ARG O 297 296 THR P Protein S 2 FT #SUB 311 310 ARG O 298 297 GLN P Protein A 19 FT #SUB 312 311 ALA O 298 297 GLN P Protein A 2 FT #SUB 312 311 ALA O 299 298 MET P Protein S 1 FT #SUB 312 311 ALA O 312 311 ALA P Protein A 10 FT #SUB 312 311 ALA O 313 312 GLU P Protein S 4 FT #SUB 312 311 ALA O 316 315 ASP P Protein A 6 FT #SUB 313 312 GLU O 312 311 ALA P Protein A 4 FT #SUB 315 314 SER O 316 315 ASP P Protein S 6 FT #SUB 316 315 ASP O 312 311 ALA P Protein S 11 FT #SUB 316 315 ASP O 315 314 SER P Protein A 4 FT #SUB 319 318 ASN O 319 318 ASN P Protein S 15 FT #SUB 353 352 GLU O 273 272 GLU P Protein S 14 FT #SUB 353 352 GLU O 274 273 LYS P Protein S 2 FT #SUB 353 352 GLU O 277 276 VAL P Protein S 1 FT #SUB 366 365 SER O 4 3 LEU P Protein A 3 FT #SUB 367 366 ILE O 4 3 LEU P Protein B 1 FT #SUB 370 369 LEU O 4 3 LEU P Protein S 1 FT #HET 400 399 LEU O 15 700 FDP O A 12 FT #HET 401 400 SER O 15 700 FDP O A 10 FT #HET 402 401 ASN O 15 700 FDP O A 12 FT #HET 403 402 THR O 15 700 FDP O A 11 FT #HET 405 404 ARG O 15 700 FDP O A 4 FT #HET 406 405 SER O 15 700 FDP O A 7 FT #HET 454 453 LYS O 15 700 FDP O S 9 FT #HET 457 456 ARG O 15 700 FDP O S 11 FT #HET 480 479 ILE O 15 700 FDP O B 1 FT #HET 481 480 HIS O 15 700 FDP O A 4 FT #HET 482 481 ALA O 15 700 FDP O A 4 FT #HET 488 487 GLY O 15 700 FDP O B 1 FT #HET 490 489 ALA O 15 700 FDP O S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQP STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 373 372 ILE P 390 389 TYR C Protein S 4 FT #SUB 373 372 ILE P 391 390 GLU C Protein A 18 FT #SUB 374 373 PRO P 391 390 GLU C Protein A 5 FT #SUB 374 373 PRO P 392 391 THR C Protein A 5 FT #SUB 374 373 PRO P 393 392 LYS C Protein S 1 FT #SUB 375 374 MET P 391 390 GLU C Protein A 5 FT #SUB 377 376 ALA P 495 494 ILE C Protein A 5 FT #SUB 380 379 ALA P 388 387 SER C Protein S 1 FT #SUB 380 379 ALA P 391 390 GLU C Protein A 2 FT #SUB 380 379 ALA P 495 494 ILE C Protein S 1 FT #SUB 383 382 SER P 391 390 GLU C Protein S 1 FT #SUB 384 383 SER P 384 383 SER C Protein S 4 FT #SUB 388 387 SER P 380 379 ALA C Protein S 1 FT #SUB 390 389 TYR P 373 372 ILE C Protein B 1 FT #SUB 391 390 GLU P 373 372 ILE C Protein A 8 FT #SUB 391 390 GLU P 374 373 PRO C Protein B 7 FT #SUB 391 390 GLU P 375 374 MET C Protein A 4 FT #SUB 391 390 GLU P 380 379 ALA C Protein S 2 FT #SUB 391 390 GLU P 383 382 SER C Protein S 1 FT #SUB 392 391 THR P 374 373 PRO C Protein B 5 FT #SUB 393 392 LYS P 374 373 PRO C Protein S 1 FT #SUB 483 482 ASP P 494 493 ARG C Protein S 2 FT #SUB 484 483 HIS P 484 483 HIS C Protein S 4 FT #SUB 491 490 ASN P 493 492 THR C Protein B 1 FT #SUB 491 490 ASN P 494 493 ARG C Protein A 2 FT #SUB 492 491 GLN P 492 491 GLN C Protein S 9 FT #SUB 492 491 GLN P 493 492 THR C Protein B 1 FT #SUB 493 492 THR P 491 490 ASN C Protein B 1 FT #SUB 493 492 THR P 492 491 GLN C Protein B 1 FT #SUB 494 493 ARG P 483 482 ASP C Protein S 2 FT #SUB 494 493 ARG P 491 490 ASN C Protein A 2 FT #SUB 495 494 ILE P 377 376 ALA C Protein S 3 FT #SUB 4 3 LEU P 284 283 SER O Protein S 2 FT #SUB 4 3 LEU P 366 365 SER O Protein S 3 FT #SUB 4 3 LEU P 367 366 ILE O Protein S 1 FT #SUB 4 3 LEU P 370 369 LEU O Protein S 1 FT #SUB 7 6 ASN P 280 279 LYS O Protein S 4 FT #SUB 7 6 ASN P 281 280 ILE O Protein B 1 FT #SUB 7 6 ASN P 284 283 SER O Protein S 2 FT #SUB 10 9 LEU P 277 276 VAL O Protein S 1 FT #SUB 10 9 LEU P 281 280 ILE O Protein B 3 FT #SUB 11 10 SER P 277 276 VAL O Protein B 2 FT #SUB 12 11 ILE P 246 245 VAL O Protein S 1 FT #SUB 12 11 ILE P 274 273 LYS O Protein A 4 FT #SUB 12 11 ILE P 277 276 VAL O Protein B 1 FT #SUB 12 11 ILE P 278 277 ALA O Protein S 3 FT #SUB 13 12 PHE P 243 242 HIS O Protein S 7 FT #SUB 243 242 HIS P 13 12 PHE O Protein S 7 FT #SUB 263 262 ARG P 311 310 ARG O Protein A 2 FT #SUB 264 263 GLY P 311 310 ARG O Protein B 2 FT #SUB 270 269 ILE P 12 11 ILE O Protein S 1 FT #SUB 273 272 GLU P 353 352 GLU O Protein A 14 FT #SUB 274 273 LYS P 12 11 ILE O Protein A 17 FT #SUB 274 273 LYS P 353 352 GLU O Protein S 2 FT #SUB 277 276 VAL P 10 9 LEU O Protein S 2 FT #SUB 277 276 VAL P 11 10 SER O Protein S 3 FT #SUB 277 276 VAL P 12 11 ILE O Protein S 1 FT #SUB 277 276 VAL P 353 352 GLU O Protein S 1 FT #SUB 278 277 ALA P 12 11 ILE O Protein A 2 FT #SUB 280 279 LYS P 3 2 GLN O Protein S 2 FT #SUB 280 279 LYS P 7 6 ASN O Protein S 8 FT #SUB 281 280 ILE P 7 6 ASN O Protein S 1 FT #SUB 281 280 ILE P 10 9 LEU O Protein S 3 FT #SUB 284 283 SER P 4 3 LEU O Protein S 2 FT #SUB 284 283 SER P 7 6 ASN O Protein S 1 FT #SUB 284 283 SER P 8 7 LEU O Protein S 1 FT #SUB 285 284 LYS P 8 7 LEU O Protein S 1 FT #SUB 297 296 THR P 311 310 ARG O Protein B 2 FT #SUB 298 297 GLN P 310 309 THR O Protein S 1 FT #SUB 298 297 GLN P 311 310 ARG O Protein S 19 FT #SUB 298 297 GLN P 312 311 ALA O Protein B 2 FT #SUB 299 298 MET P 312 311 ALA O Protein B 1 FT #SUB 310 309 THR P 298 297 GLN O Protein B 1 FT #SUB 311 310 ARG P 263 262 ARG O Protein S 7 FT #SUB 311 310 ARG P 264 263 GLY O Protein S 4 FT #SUB 311 310 ARG P 297 296 THR O Protein S 2 FT #SUB 311 310 ARG P 298 297 GLN O Protein A 13 FT #SUB 312 311 ALA P 298 297 GLN O Protein A 2 FT #SUB 312 311 ALA P 299 298 MET O Protein S 1 FT #SUB 312 311 ALA P 312 311 ALA O Protein A 10 FT #SUB 312 311 ALA P 313 312 GLU O Protein S 4 FT #SUB 312 311 ALA P 316 315 ASP O Protein A 11 FT #SUB 313 312 GLU P 312 311 ALA O Protein A 4 FT #SUB 315 314 SER P 316 315 ASP O Protein S 4 FT #SUB 316 315 ASP P 312 311 ALA O Protein S 6 FT #SUB 316 315 ASP P 315 314 SER O Protein A 6 FT #SUB 319 318 ASN P 319 318 ASN O Protein S 15 FT #SUB 349 348 ARG P 273 272 GLU O Protein S 3 FT #SUB 353 352 GLU P 273 272 GLU O Protein S 10 FT #SUB 353 352 GLU P 274 273 LYS O Protein S 1 FT #SUB 353 352 GLU P 277 276 VAL O Protein S 1 FT #SUB 366 365 SER P 4 3 LEU O Protein S 1 FT #SUB 58 57 HIS P 499 498 GLU U Protein S 1 FT #SUB 192 191 ALA P 473 472 THR U Protein S 1 FT #SUB 192 191 ALA P 474 473 GLY U Protein A 2 FT #SUB 196 195 VAL P 497 496 LEU U Protein A 8 FT #SUB 196 195 VAL P 499 498 GLU U Protein S 1 FT #SUB 199 198 GLN P 487 486 LYS V Protein S 2 FT #SUB 229 228 PRO P 405 404 ARG V Protein S 2 FT #SUB 230 229 LYS P 488 487 GLY V Protein S 8 FT #SUB 232 231 ARG P 232 231 ARG V Protein S 2 FT #SUB 405 404 ARG P 229 228 PRO V Protein S 4 FT #SUB 487 486 LYS P 199 198 GLN V Protein B 1 FT #SUB 487 486 LYS P 230 229 LYS V Protein B 1 FT #SUB 488 487 GLY P 230 229 LYS V Protein B 14 FT #HET 230 229 LYS P 22 700 FDP V S 3 FT #HET 400 399 LEU P 16 700 FDP P A 12 FT #HET 401 400 SER P 16 700 FDP P A 10 FT #HET 402 401 ASN P 16 700 FDP P A 12 FT #HET 403 402 THR P 16 700 FDP P A 11 FT #HET 405 404 ARG P 16 700 FDP P A 4 FT #HET 406 405 SER P 16 700 FDP P A 7 FT #HET 454 453 LYS P 16 700 FDP P S 9 FT #HET 457 456 ARG P 16 700 FDP P S 11 FT #HET 480 479 ILE P 16 700 FDP P B 1 FT #HET 481 480 HIS P 16 700 FDP P A 4 FT #HET 482 481 ALA P 16 700 FDP P A 4 FT #HET 488 487 GLY P 16 700 FDP P B 1 FT #HET 490 489 ALA P 16 700 FDP P S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQQ STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 373 372 ILE Q 390 389 TYR R Protein S 1 FT #SUB 373 372 ILE Q 391 390 GLU R Protein S 1 FT #SUB 374 373 PRO Q 391 390 GLU R Protein A 7 FT #SUB 374 373 PRO Q 392 391 THR R Protein S 4 FT #SUB 374 373 PRO Q 393 392 LYS R Protein S 3 FT #SUB 375 374 MET Q 391 390 GLU R Protein A 4 FT #SUB 377 376 ALA Q 495 494 ILE R Protein A 6 FT #SUB 380 379 ALA Q 388 387 SER R Protein S 1 FT #SUB 380 379 ALA Q 391 390 GLU R Protein A 6 FT #SUB 383 382 SER Q 391 390 GLU R Protein S 1 FT #SUB 384 383 SER Q 384 383 SER R Protein A 8 FT #SUB 384 383 SER Q 387 386 ASN R Protein S 1 FT #SUB 388 387 SER Q 380 379 ALA R Protein S 1 FT #SUB 390 389 TYR Q 373 372 ILE R Protein B 1 FT #SUB 391 390 GLU Q 373 372 ILE R Protein A 14 FT #SUB 391 390 GLU Q 374 373 PRO R Protein B 5 FT #SUB 391 390 GLU Q 375 374 MET R Protein A 5 FT #SUB 391 390 GLU Q 380 379 ALA R Protein S 2 FT #SUB 391 390 GLU Q 383 382 SER R Protein S 1 FT #SUB 392 391 THR Q 374 373 PRO R Protein B 3 FT #SUB 483 482 ASP Q 494 493 ARG R Protein S 6 FT #SUB 484 483 HIS Q 484 483 HIS R Protein S 4 FT #SUB 491 490 ASN Q 493 492 THR R Protein B 3 FT #SUB 491 490 ASN Q 494 493 ARG R Protein A 2 FT #SUB 491 490 ASN Q 495 494 ILE R Protein A 2 FT #SUB 492 491 GLN Q 492 491 GLN R Protein S 10 FT #SUB 492 491 GLN Q 493 492 THR R Protein A 3 FT #SUB 493 492 THR Q 491 490 ASN R Protein B 1 FT #SUB 493 492 THR Q 492 491 GLN R Protein B 1 FT #SUB 493 492 THR Q 493 492 THR R Protein B 2 FT #SUB 494 493 ARG Q 483 482 ASP R Protein S 3 FT #SUB 494 493 ARG Q 491 490 ASN R Protein A 3 FT #SUB 495 494 ILE Q 377 376 ALA R Protein S 5 FT #SUB 495 494 ILE Q 380 379 ALA R Protein S 1 FT #SUB 3 2 GLN Q 280 279 LYS S Protein S 1 FT #SUB 4 3 LEU Q 284 283 SER S Protein S 5 FT #SUB 4 3 LEU Q 288 287 VAL S Protein S 1 FT #SUB 4 3 LEU Q 370 369 LEU S Protein S 1 FT #SUB 7 6 ASN Q 280 279 LYS S Protein S 5 FT #SUB 7 6 ASN Q 281 280 ILE S Protein B 5 FT #SUB 7 6 ASN Q 284 283 SER S Protein S 3 FT #SUB 8 7 LEU Q 285 284 LYS S Protein S 2 FT #SUB 10 9 LEU Q 277 276 VAL S Protein S 2 FT #SUB 10 9 LEU Q 281 280 ILE S Protein A 5 FT #SUB 12 11 ILE Q 270 269 ILE S Protein S 1 FT #SUB 12 11 ILE Q 274 273 LYS S Protein A 13 FT #SUB 13 12 PHE Q 243 242 HIS S Protein S 5 FT #SUB 243 242 HIS Q 13 12 PHE S Protein S 9 FT #SUB 263 262 ARG Q 311 310 ARG S Protein A 2 FT #SUB 264 263 GLY Q 311 310 ARG S Protein B 1 FT #SUB 270 269 ILE Q 12 11 ILE S Protein S 2 FT #SUB 273 272 GLU Q 353 352 GLU S Protein A 15 FT #SUB 274 273 LYS Q 12 11 ILE S Protein A 10 FT #SUB 274 273 LYS Q 353 352 GLU S Protein A 7 FT #SUB 276 275 VAL Q 322 321 PHE S Protein S 2 FT #SUB 277 276 VAL Q 10 9 LEU S Protein S 3 FT #SUB 277 276 VAL Q 353 352 GLU S Protein S 1 FT #SUB 278 277 ALA Q 12 11 ILE S Protein S 1 FT #SUB 280 279 LYS Q 3 2 GLN S Protein S 2 FT #SUB 280 279 LYS Q 7 6 ASN S Protein A 13 FT #SUB 281 280 ILE Q 7 6 ASN S Protein A 6 FT #SUB 281 280 ILE Q 8 7 LEU S Protein B 1 FT #SUB 281 280 ILE Q 10 9 LEU S Protein S 6 FT #SUB 284 283 SER Q 4 3 LEU S Protein A 10 FT #SUB 284 283 SER Q 7 6 ASN S Protein S 2 FT #SUB 285 284 LYS Q 8 7 LEU S Protein A 5 FT #SUB 288 287 VAL Q 4 3 LEU S Protein S 1 FT #SUB 297 296 THR Q 311 310 ARG S Protein B 2 FT #SUB 298 297 GLN Q 311 310 ARG S Protein S 20 FT #SUB 298 297 GLN Q 312 311 ALA S Protein B 2 FT #SUB 299 298 MET Q 312 311 ALA S Protein B 1 FT #SUB 311 310 ARG Q 263 262 ARG S Protein S 2 FT #SUB 311 310 ARG Q 264 263 GLY S Protein S 1 FT #SUB 311 310 ARG Q 297 296 THR S Protein S 2 FT #SUB 311 310 ARG Q 298 297 GLN S Protein A 16 FT #SUB 312 311 ALA Q 298 297 GLN S Protein A 2 FT #SUB 312 311 ALA Q 312 311 ALA S Protein A 10 FT #SUB 312 311 ALA Q 313 312 GLU S Protein S 4 FT #SUB 312 311 ALA Q 316 315 ASP S Protein A 6 FT #SUB 313 312 GLU Q 312 311 ALA S Protein A 4 FT #SUB 315 314 SER Q 316 315 ASP S Protein S 3 FT #SUB 316 315 ASP Q 312 311 ALA S Protein S 4 FT #SUB 316 315 ASP Q 315 314 SER S Protein A 5 FT #SUB 319 318 ASN Q 319 318 ASN S Protein S 11 FT #SUB 322 321 PHE Q 276 275 VAL S Protein S 1 FT #SUB 353 352 GLU Q 273 272 GLU S Protein S 10 FT #SUB 353 352 GLU Q 274 273 LYS S Protein S 5 FT #SUB 353 352 GLU Q 277 276 VAL S Protein S 1 FT #SUB 370 369 LEU Q 4 3 LEU S Protein S 1 FT #HET 400 399 LEU Q 17 700 FDP Q A 11 FT #HET 401 400 SER Q 17 700 FDP Q A 9 FT #HET 402 401 ASN Q 17 700 FDP Q A 12 FT #HET 403 402 THR Q 17 700 FDP Q A 11 FT #HET 405 404 ARG Q 17 700 FDP Q A 5 FT #HET 406 405 SER Q 17 700 FDP Q A 7 FT #HET 454 453 LYS Q 17 700 FDP Q S 8 FT #HET 457 456 ARG Q 17 700 FDP Q S 9 FT #HET 480 479 ILE Q 17 700 FDP Q B 1 FT #HET 481 480 HIS Q 17 700 FDP Q A 3 FT #HET 482 481 ALA Q 17 700 FDP Q A 4 FT #HET 487 486 LYS Q 17 700 FDP Q B 1 FT #HET 488 487 GLY Q 17 700 FDP Q B 1 FT #HET 489 488 TYR Q 17 700 FDP Q B 2 FT #HET 490 489 ALA Q 17 700 FDP Q S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQR STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 373 372 ILE R 390 389 TYR Q Protein S 1 FT #SUB 373 372 ILE R 391 390 GLU Q Protein A 14 FT #SUB 374 373 PRO R 391 390 GLU Q Protein A 5 FT #SUB 374 373 PRO R 392 391 THR Q Protein S 3 FT #SUB 375 374 MET R 391 390 GLU Q Protein A 5 FT #SUB 377 376 ALA R 495 494 ILE Q Protein A 5 FT #SUB 380 379 ALA R 388 387 SER Q Protein S 1 FT #SUB 380 379 ALA R 391 390 GLU Q Protein A 2 FT #SUB 380 379 ALA R 495 494 ILE Q Protein S 1 FT #SUB 383 382 SER R 391 390 GLU Q Protein S 1 FT #SUB 384 383 SER R 384 383 SER Q Protein A 8 FT #SUB 387 386 ASN R 384 383 SER Q Protein S 1 FT #SUB 388 387 SER R 380 379 ALA Q Protein S 1 FT #SUB 390 389 TYR R 373 372 ILE Q Protein B 1 FT #SUB 391 390 GLU R 373 372 ILE Q Protein S 1 FT #SUB 391 390 GLU R 374 373 PRO Q Protein B 7 FT #SUB 391 390 GLU R 375 374 MET Q Protein A 4 FT #SUB 391 390 GLU R 380 379 ALA Q Protein S 6 FT #SUB 391 390 GLU R 383 382 SER Q Protein S 1 FT #SUB 392 391 THR R 374 373 PRO Q Protein B 4 FT #SUB 393 392 LYS R 374 373 PRO Q Protein S 3 FT #SUB 483 482 ASP R 494 493 ARG Q Protein S 3 FT #SUB 484 483 HIS R 484 483 HIS Q Protein S 4 FT #SUB 491 490 ASN R 493 492 THR Q Protein B 1 FT #SUB 491 490 ASN R 494 493 ARG Q Protein B 3 FT #SUB 492 491 GLN R 492 491 GLN Q Protein S 10 FT #SUB 492 491 GLN R 493 492 THR Q Protein B 1 FT #SUB 493 492 THR R 491 490 ASN Q Protein B 3 FT #SUB 493 492 THR R 492 491 GLN Q Protein B 3 FT #SUB 493 492 THR R 493 492 THR Q Protein B 2 FT #SUB 494 493 ARG R 483 482 ASP Q Protein S 6 FT #SUB 494 493 ARG R 491 490 ASN Q Protein A 2 FT #SUB 495 494 ILE R 377 376 ALA Q Protein S 6 FT #SUB 495 494 ILE R 491 490 ASN Q Protein B 2 FT #SUB 4 3 LEU R 284 283 SER T Protein S 3 FT #SUB 4 3 LEU R 288 287 VAL T Protein S 2 FT #SUB 4 3 LEU R 366 365 SER T Protein S 1 FT #SUB 4 3 LEU R 370 369 LEU T Protein S 3 FT #SUB 7 6 ASN R 280 279 LYS T Protein S 1 FT #SUB 7 6 ASN R 281 280 ILE T Protein B 1 FT #SUB 7 6 ASN R 284 283 SER T Protein S 1 FT #SUB 8 7 LEU R 285 284 LYS T Protein S 1 FT #SUB 10 9 LEU R 281 280 ILE T Protein B 1 FT #SUB 12 11 ILE R 274 273 LYS T Protein A 5 FT #SUB 13 12 PHE R 243 242 HIS T Protein S 5 FT #SUB 243 242 HIS R 13 12 PHE T Protein S 5 FT #SUB 270 269 ILE R 12 11 ILE T Protein S 5 FT #SUB 273 272 GLU R 353 352 GLU T Protein A 19 FT #SUB 274 273 LYS R 12 11 ILE T Protein A 16 FT #SUB 274 273 LYS R 353 352 GLU T Protein A 6 FT #SUB 276 275 VAL R 322 321 PHE T Protein S 2 FT #SUB 277 276 VAL R 10 9 LEU T Protein S 5 FT #SUB 277 276 VAL R 11 10 SER T Protein S 1 FT #SUB 277 276 VAL R 357 356 ALA T Protein S 1 FT #SUB 280 279 LYS R 3 2 GLN T Protein S 5 FT #SUB 280 279 LYS R 7 6 ASN T Protein A 22 FT #SUB 281 280 ILE R 7 6 ASN T Protein A 12 FT #SUB 281 280 ILE R 8 7 LEU T Protein A 3 FT #SUB 281 280 ILE R 10 9 LEU T Protein S 7 FT #SUB 284 283 SER R 4 3 LEU T Protein A 12 FT #SUB 284 283 SER R 7 6 ASN T Protein S 2 FT #SUB 285 284 LYS R 8 7 LEU T Protein A 7 FT #SUB 288 287 VAL R 4 3 LEU T Protein S 2 FT #SUB 298 297 GLN R 311 310 ARG T Protein S 13 FT #SUB 298 297 GLN R 312 311 ALA T Protein B 2 FT #SUB 311 310 ARG R 263 262 ARG T Protein S 3 FT #SUB 311 310 ARG R 264 263 GLY T Protein S 1 FT #SUB 311 310 ARG R 267 266 GLY T Protein S 1 FT #SUB 311 310 ARG R 298 297 GLN T Protein A 7 FT #SUB 312 311 ALA R 312 311 ALA T Protein A 7 FT #SUB 312 311 ALA R 313 312 GLU T Protein S 2 FT #SUB 312 311 ALA R 316 315 ASP T Protein A 7 FT #SUB 313 312 GLU R 312 311 ALA T Protein A 3 FT #SUB 314 313 VAL R 276 275 VAL T Protein S 1 FT #SUB 315 314 SER R 276 275 VAL T Protein B 1 FT #SUB 315 314 SER R 316 315 ASP T Protein S 2 FT #SUB 316 315 ASP R 315 314 SER T Protein S 4 FT #SUB 319 318 ASN R 319 318 ASN T Protein S 7 FT #SUB 349 348 ARG R 273 272 GLU T Protein S 1 FT #SUB 353 352 GLU R 273 272 GLU T Protein S 1 FT #SUB 353 352 GLU R 274 273 LYS T Protein S 2 FT #SUB 353 352 GLU R 277 276 VAL T Protein S 1 FT #SUB 370 369 LEU R 4 3 LEU T Protein S 1 FT #HET 400 399 LEU R 18 700 FDP R A 11 FT #HET 401 400 SER R 18 700 FDP R A 9 FT #HET 402 401 ASN R 18 700 FDP R A 12 FT #HET 403 402 THR R 18 700 FDP R A 11 FT #HET 405 404 ARG R 18 700 FDP R A 4 FT #HET 406 405 SER R 18 700 FDP R A 7 FT #HET 454 453 LYS R 18 700 FDP R S 8 FT #HET 457 456 ARG R 18 700 FDP R S 9 FT #HET 480 479 ILE R 18 700 FDP R B 1 FT #HET 481 480 HIS R 18 700 FDP R A 3 FT #HET 482 481 ALA R 18 700 FDP R A 4 FT #HET 487 486 LYS R 18 700 FDP R B 1 FT #HET 488 487 GLY R 18 700 FDP R B 1 FT #HET 489 488 TYR R 18 700 FDP R B 2 FT #HET 490 489 ALA R 18 700 FDP R S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQS STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 58 57 HIS S 499 498 GLU K Protein S 1 FT #SUB 192 191 ALA S 473 472 THR K Protein S 1 FT #SUB 192 191 ALA S 474 473 GLY K Protein A 2 FT #SUB 196 195 VAL S 474 473 GLY K Protein S 2 FT #SUB 196 195 VAL S 497 496 LEU K Protein A 6 FT #SUB 196 195 VAL S 498 497 VAL K Protein S 1 FT #SUB 196 195 VAL S 499 498 GLU K Protein S 2 FT #SUB 199 198 GLN S 487 486 LYS L Protein S 1 FT #SUB 229 228 PRO S 405 404 ARG L Protein S 4 FT #SUB 230 229 LYS S 488 487 GLY L Protein S 10 FT #SUB 232 231 ARG S 232 231 ARG L Protein S 3 FT #SUB 405 404 ARG S 229 228 PRO L Protein S 3 FT #SUB 487 486 LYS S 199 198 GLN L Protein B 1 FT #SUB 488 487 GLY S 230 229 LYS L Protein B 8 FT #SUB 3 2 GLN S 280 279 LYS Q Protein S 2 FT #SUB 4 3 LEU S 284 283 SER Q Protein A 10 FT #SUB 4 3 LEU S 288 287 VAL Q Protein S 1 FT #SUB 4 3 LEU S 370 369 LEU Q Protein S 1 FT #SUB 7 6 ASN S 280 279 LYS Q Protein S 13 FT #SUB 7 6 ASN S 281 280 ILE Q Protein B 6 FT #SUB 7 6 ASN S 284 283 SER Q Protein S 2 FT #SUB 8 7 LEU S 281 280 ILE Q Protein S 1 FT #SUB 8 7 LEU S 285 284 LYS Q Protein S 5 FT #SUB 10 9 LEU S 277 276 VAL Q Protein S 3 FT #SUB 10 9 LEU S 281 280 ILE Q Protein A 6 FT #SUB 12 11 ILE S 270 269 ILE Q Protein S 2 FT #SUB 12 11 ILE S 274 273 LYS Q Protein A 10 FT #SUB 12 11 ILE S 278 277 ALA Q Protein S 1 FT #SUB 13 12 PHE S 243 242 HIS Q Protein S 9 FT #SUB 243 242 HIS S 13 12 PHE Q Protein S 5 FT #SUB 263 262 ARG S 311 310 ARG Q Protein A 2 FT #SUB 264 263 GLY S 311 310 ARG Q Protein B 1 FT #SUB 270 269 ILE S 12 11 ILE Q Protein S 1 FT #SUB 273 272 GLU S 353 352 GLU Q Protein A 10 FT #SUB 274 273 LYS S 12 11 ILE Q Protein A 13 FT #SUB 274 273 LYS S 353 352 GLU Q Protein S 5 FT #SUB 276 275 VAL S 322 321 PHE Q Protein S 1 FT #SUB 277 276 VAL S 10 9 LEU Q Protein S 2 FT #SUB 277 276 VAL S 353 352 GLU Q Protein S 1 FT #SUB 280 279 LYS S 3 2 GLN Q Protein S 1 FT #SUB 280 279 LYS S 7 6 ASN Q Protein A 5 FT #SUB 281 280 ILE S 7 6 ASN Q Protein A 5 FT #SUB 281 280 ILE S 10 9 LEU Q Protein S 5 FT #SUB 284 283 SER S 4 3 LEU Q Protein A 5 FT #SUB 284 283 SER S 7 6 ASN Q Protein S 3 FT #SUB 285 284 LYS S 8 7 LEU Q Protein S 2 FT #SUB 288 287 VAL S 4 3 LEU Q Protein S 1 FT #SUB 297 296 THR S 311 310 ARG Q Protein B 2 FT #SUB 298 297 GLN S 311 310 ARG Q Protein S 16 FT #SUB 298 297 GLN S 312 311 ALA Q Protein B 2 FT #SUB 311 310 ARG S 263 262 ARG Q Protein S 2 FT #SUB 311 310 ARG S 264 263 GLY Q Protein S 1 FT #SUB 311 310 ARG S 297 296 THR Q Protein S 2 FT #SUB 311 310 ARG S 298 297 GLN Q Protein A 20 FT #SUB 312 311 ALA S 298 297 GLN Q Protein A 2 FT #SUB 312 311 ALA S 299 298 MET Q Protein S 1 FT #SUB 312 311 ALA S 312 311 ALA Q Protein A 10 FT #SUB 312 311 ALA S 313 312 GLU Q Protein S 4 FT #SUB 312 311 ALA S 316 315 ASP Q Protein A 4 FT #SUB 313 312 GLU S 312 311 ALA Q Protein A 4 FT #SUB 315 314 SER S 316 315 ASP Q Protein S 5 FT #SUB 316 315 ASP S 312 311 ALA Q Protein S 6 FT #SUB 316 315 ASP S 315 314 SER Q Protein A 3 FT #SUB 319 318 ASN S 319 318 ASN Q Protein S 11 FT #SUB 322 321 PHE S 276 275 VAL Q Protein S 2 FT #SUB 353 352 GLU S 273 272 GLU Q Protein S 15 FT #SUB 353 352 GLU S 274 273 LYS Q Protein S 7 FT #SUB 353 352 GLU S 277 276 VAL Q Protein S 1 FT #SUB 370 369 LEU S 4 3 LEU Q Protein S 1 FT #SUB 373 372 ILE S 390 389 TYR T Protein S 3 FT #SUB 373 372 ILE S 391 390 GLU T Protein A 21 FT #SUB 374 373 PRO S 391 390 GLU T Protein A 6 FT #SUB 374 373 PRO S 392 391 THR T Protein A 10 FT #SUB 375 374 MET S 391 390 GLU T Protein A 5 FT #SUB 377 376 ALA S 495 494 ILE T Protein A 7 FT #SUB 380 379 ALA S 388 387 SER T Protein S 1 FT #SUB 380 379 ALA S 495 494 ILE T Protein S 1 FT #SUB 384 383 SER S 384 383 SER T Protein A 6 FT #SUB 387 386 ASN S 384 383 SER T Protein S 1 FT #SUB 388 387 SER S 380 379 ALA T Protein S 1 FT #SUB 391 390 GLU S 374 373 PRO T Protein B 6 FT #SUB 391 390 GLU S 375 374 MET T Protein A 4 FT #SUB 391 390 GLU S 380 379 ALA T Protein S 7 FT #SUB 391 390 GLU S 383 382 SER T Protein S 1 FT #SUB 392 391 THR S 374 373 PRO T Protein B 1 FT #SUB 483 482 ASP S 494 493 ARG T Protein S 3 FT #SUB 484 483 HIS S 484 483 HIS T Protein S 10 FT #SUB 491 490 ASN S 493 492 THR T Protein B 3 FT #SUB 491 490 ASN S 494 493 ARG T Protein A 6 FT #SUB 492 491 GLN S 483 482 ASP T Protein S 1 FT #SUB 492 491 GLN S 492 491 GLN T Protein S 13 FT #SUB 492 491 GLN S 493 492 THR T Protein B 1 FT #SUB 493 492 THR S 491 490 ASN T Protein B 3 FT #SUB 493 492 THR S 492 491 GLN T Protein B 4 FT #SUB 494 493 ARG S 483 482 ASP T Protein S 11 FT #SUB 494 493 ARG S 491 490 ASN T Protein A 5 FT #SUB 495 494 ILE S 377 376 ALA T Protein S 5 FT #SUB 495 494 ILE S 489 488 TYR T Protein B 1 FT #SUB 495 494 ILE S 491 490 ASN T Protein B 2 FT #HET 230 229 LYS S 12 700 FDP L S 1 FT #HET 400 399 LEU S 19 700 FDP S A 11 FT #HET 401 400 SER S 19 700 FDP S A 9 FT #HET 402 401 ASN S 19 700 FDP S A 12 FT #HET 403 402 THR S 19 700 FDP S A 11 FT #HET 405 404 ARG S 19 700 FDP S A 5 FT #HET 406 405 SER S 19 700 FDP S A 7 FT #HET 454 453 LYS S 19 700 FDP S S 8 FT #HET 457 456 ARG S 19 700 FDP S S 9 FT #HET 480 479 ILE S 19 700 FDP S B 1 FT #HET 481 480 HIS S 19 700 FDP S A 3 FT #HET 482 481 ALA S 19 700 FDP S A 4 FT #HET 487 486 LYS S 19 700 FDP S B 1 FT #HET 488 487 GLY S 19 700 FDP S B 1 FT #HET 489 488 TYR S 19 700 FDP S B 2 FT #HET 490 489 ALA S 19 700 FDP S S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQT STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 473 472 THR T 192 191 ALA L Protein B 1 FT #SUB 474 473 GLY T 192 191 ALA L Protein B 1 FT #SUB 497 496 LEU T 196 195 VAL L Protein S 2 FT #SUB 498 497 VAL T 196 195 VAL L Protein B 1 FT #SUB 499 498 GLU T 196 195 VAL L Protein S 2 FT #SUB 3 2 GLN T 280 279 LYS R Protein S 5 FT #SUB 4 3 LEU T 284 283 SER R Protein A 12 FT #SUB 4 3 LEU T 288 287 VAL R Protein S 2 FT #SUB 4 3 LEU T 370 369 LEU R Protein S 1 FT #SUB 7 6 ASN T 280 279 LYS R Protein S 22 FT #SUB 7 6 ASN T 281 280 ILE R Protein A 12 FT #SUB 7 6 ASN T 284 283 SER R Protein S 2 FT #SUB 8 7 LEU T 281 280 ILE R Protein A 3 FT #SUB 8 7 LEU T 285 284 LYS R Protein S 7 FT #SUB 10 9 LEU T 277 276 VAL R Protein A 5 FT #SUB 10 9 LEU T 281 280 ILE R Protein A 7 FT #SUB 11 10 SER T 277 276 VAL R Protein B 1 FT #SUB 12 11 ILE T 270 269 ILE R Protein S 5 FT #SUB 12 11 ILE T 274 273 LYS R Protein A 16 FT #SUB 13 12 PHE T 243 242 HIS R Protein S 5 FT #SUB 243 242 HIS T 13 12 PHE R Protein S 5 FT #SUB 263 262 ARG T 311 310 ARG R Protein A 3 FT #SUB 264 263 GLY T 311 310 ARG R Protein B 1 FT #SUB 267 266 GLY T 311 310 ARG R Protein B 1 FT #SUB 273 272 GLU T 349 348 ARG R Protein S 1 FT #SUB 273 272 GLU T 353 352 GLU R Protein B 1 FT #SUB 274 273 LYS T 12 11 ILE R Protein S 5 FT #SUB 274 273 LYS T 353 352 GLU R Protein S 2 FT #SUB 276 275 VAL T 314 313 VAL R Protein S 1 FT #SUB 276 275 VAL T 315 314 SER R Protein S 1 FT #SUB 277 276 VAL T 353 352 GLU R Protein S 1 FT #SUB 280 279 LYS T 7 6 ASN R Protein S 1 FT #SUB 281 280 ILE T 7 6 ASN R Protein S 1 FT #SUB 281 280 ILE T 10 9 LEU R Protein S 1 FT #SUB 284 283 SER T 4 3 LEU R Protein A 3 FT #SUB 284 283 SER T 7 6 ASN R Protein S 1 FT #SUB 285 284 LYS T 8 7 LEU R Protein S 1 FT #SUB 288 287 VAL T 4 3 LEU R Protein S 2 FT #SUB 298 297 GLN T 311 310 ARG R Protein S 7 FT #SUB 311 310 ARG T 298 297 GLN R Protein A 13 FT #SUB 312 311 ALA T 298 297 GLN R Protein A 2 FT #SUB 312 311 ALA T 312 311 ALA R Protein A 7 FT #SUB 312 311 ALA T 313 312 GLU R Protein S 3 FT #SUB 313 312 GLU T 312 311 ALA R Protein B 2 FT #SUB 315 314 SER T 316 315 ASP R Protein S 4 FT #SUB 316 315 ASP T 312 311 ALA R Protein S 7 FT #SUB 316 315 ASP T 315 314 SER R Protein S 2 FT #SUB 319 318 ASN T 319 318 ASN R Protein S 7 FT #SUB 322 321 PHE T 276 275 VAL R Protein S 2 FT #SUB 353 352 GLU T 273 272 GLU R Protein S 19 FT #SUB 353 352 GLU T 274 273 LYS R Protein S 6 FT #SUB 357 356 ALA T 277 276 VAL R Protein S 1 FT #SUB 366 365 SER T 4 3 LEU R Protein B 1 FT #SUB 370 369 LEU T 4 3 LEU R Protein S 3 FT #SUB 374 373 PRO T 391 390 GLU S Protein A 6 FT #SUB 374 373 PRO T 392 391 THR S Protein S 1 FT #SUB 375 374 MET T 391 390 GLU S Protein A 4 FT #SUB 377 376 ALA T 495 494 ILE S Protein A 5 FT #SUB 380 379 ALA T 388 387 SER S Protein S 1 FT #SUB 380 379 ALA T 391 390 GLU S Protein A 7 FT #SUB 383 382 SER T 391 390 GLU S Protein S 1 FT #SUB 384 383 SER T 384 383 SER S Protein S 6 FT #SUB 384 383 SER T 387 386 ASN S Protein S 1 FT #SUB 388 387 SER T 380 379 ALA S Protein S 1 FT #SUB 390 389 TYR T 373 372 ILE S Protein B 3 FT #SUB 391 390 GLU T 373 372 ILE S Protein A 21 FT #SUB 391 390 GLU T 374 373 PRO S Protein B 6 FT #SUB 391 390 GLU T 375 374 MET S Protein A 5 FT #SUB 392 391 THR T 374 373 PRO S Protein A 10 FT #SUB 483 482 ASP T 492 491 GLN S Protein S 1 FT #SUB 483 482 ASP T 494 493 ARG S Protein S 11 FT #SUB 484 483 HIS T 484 483 HIS S Protein S 10 FT #SUB 489 488 TYR T 495 494 ILE S Protein S 1 FT #SUB 491 490 ASN T 493 492 THR S Protein B 3 FT #SUB 491 490 ASN T 494 493 ARG S Protein A 5 FT #SUB 491 490 ASN T 495 494 ILE S Protein S 2 FT #SUB 492 491 GLN T 492 491 GLN S Protein S 13 FT #SUB 492 491 GLN T 493 492 THR S Protein A 4 FT #SUB 493 492 THR T 491 490 ASN S Protein B 3 FT #SUB 493 492 THR T 492 491 GLN S Protein B 1 FT #SUB 494 493 ARG T 483 482 ASP S Protein S 3 FT #SUB 494 493 ARG T 491 490 ASN S Protein A 6 FT #SUB 495 494 ILE T 377 376 ALA S Protein A 7 FT #SUB 495 494 ILE T 380 379 ALA S Protein S 1 FT #HET 400 399 LEU T 20 700 FDP T A 12 FT #HET 401 400 SER T 20 700 FDP T A 10 FT #HET 402 401 ASN T 20 700 FDP T A 12 FT #HET 403 402 THR T 20 700 FDP T A 11 FT #HET 405 404 ARG T 20 700 FDP T A 4 FT #HET 406 405 SER T 20 700 FDP T A 7 FT #HET 454 453 LYS T 20 700 FDP T S 9 FT #HET 457 456 ARG T 20 700 FDP T S 11 FT #HET 480 479 ILE T 20 700 FDP T B 1 FT #HET 481 480 HIS T 20 700 FDP T A 4 FT #HET 482 481 ALA T 20 700 FDP T A 4 FT #HET 488 487 GLY T 20 700 FDP T B 1 FT #HET 490 489 ALA T 20 700 FDP T S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQU STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 473 472 THR U 192 191 ALA P Protein B 1 FT #SUB 474 473 GLY U 192 191 ALA P Protein B 2 FT #SUB 497 496 LEU U 196 195 VAL P Protein S 8 FT #SUB 499 498 GLU U 58 57 HIS P Protein S 1 FT #SUB 499 498 GLU U 196 195 VAL P Protein S 1 FT #SUB 373 372 ILE U 390 389 TYR V Protein S 2 FT #SUB 373 372 ILE U 391 390 GLU V Protein A 19 FT #SUB 374 373 PRO U 391 390 GLU V Protein A 6 FT #SUB 374 373 PRO U 392 391 THR V Protein A 7 FT #SUB 375 374 MET U 391 390 GLU V Protein A 5 FT #SUB 377 376 ALA U 495 494 ILE V Protein A 3 FT #SUB 380 379 ALA U 388 387 SER V Protein S 1 FT #SUB 380 379 ALA U 495 494 ILE V Protein S 1 FT #SUB 384 383 SER U 384 383 SER V Protein S 4 FT #SUB 387 386 ASN U 384 383 SER V Protein S 1 FT #SUB 388 387 SER U 380 379 ALA V Protein S 1 FT #SUB 390 389 TYR U 373 372 ILE V Protein B 1 FT #SUB 391 390 GLU U 373 372 ILE V Protein S 1 FT #SUB 391 390 GLU U 374 373 PRO V Protein B 7 FT #SUB 391 390 GLU U 375 374 MET V Protein A 4 FT #SUB 391 390 GLU U 380 379 ALA V Protein S 8 FT #SUB 391 390 GLU U 383 382 SER V Protein S 1 FT #SUB 392 391 THR U 374 373 PRO V Protein B 4 FT #SUB 393 392 LYS U 374 373 PRO V Protein S 3 FT #SUB 483 482 ASP U 494 493 ARG V Protein S 2 FT #SUB 484 483 HIS U 484 483 HIS V Protein S 4 FT #SUB 491 490 ASN U 493 492 THR V Protein B 1 FT #SUB 491 490 ASN U 494 493 ARG V Protein B 3 FT #SUB 492 491 GLN U 492 491 GLN V Protein S 9 FT #SUB 493 492 THR U 491 490 ASN V Protein B 3 FT #SUB 493 492 THR U 492 491 GLN V Protein B 3 FT #SUB 494 493 ARG U 483 482 ASP V Protein S 7 FT #SUB 494 493 ARG U 491 490 ASN V Protein A 4 FT #SUB 495 494 ILE U 377 376 ALA V Protein S 3 FT #SUB 3 2 GLN U 280 279 LYS W Protein S 2 FT #SUB 4 3 LEU U 284 283 SER W Protein S 2 FT #SUB 4 3 LEU U 370 369 LEU W Protein S 1 FT #SUB 7 6 ASN U 280 279 LYS W Protein S 8 FT #SUB 7 6 ASN U 281 280 ILE W Protein B 2 FT #SUB 7 6 ASN U 284 283 SER W Protein S 1 FT #SUB 8 7 LEU U 285 284 LYS W Protein S 1 FT #SUB 10 9 LEU U 277 276 VAL W Protein A 2 FT #SUB 10 9 LEU U 281 280 ILE W Protein B 3 FT #SUB 11 10 SER U 277 276 VAL W Protein B 2 FT #SUB 12 11 ILE U 270 269 ILE W Protein S 1 FT #SUB 12 11 ILE U 274 273 LYS W Protein A 18 FT #SUB 12 11 ILE U 277 276 VAL W Protein B 1 FT #SUB 13 12 PHE U 243 242 HIS W Protein S 7 FT #SUB 243 242 HIS U 13 12 PHE W Protein S 10 FT #SUB 246 245 VAL U 12 11 ILE W Protein S 1 FT #SUB 263 262 ARG U 311 310 ARG W Protein A 12 FT #SUB 264 263 GLY U 311 310 ARG W Protein B 7 FT #SUB 270 269 ILE U 12 11 ILE W Protein S 1 FT #SUB 273 272 GLU U 349 348 ARG W Protein S 6 FT #SUB 273 272 GLU U 353 352 GLU W Protein A 12 FT #SUB 274 273 LYS U 12 11 ILE W Protein A 3 FT #SUB 274 273 LYS U 353 352 GLU W Protein S 2 FT #SUB 277 276 VAL U 10 9 LEU W Protein S 1 FT #SUB 277 276 VAL U 11 10 SER W Protein S 2 FT #SUB 277 276 VAL U 12 11 ILE W Protein S 1 FT #SUB 277 276 VAL U 353 352 GLU W Protein S 1 FT #SUB 278 277 ALA U 12 11 ILE W Protein A 3 FT #SUB 280 279 LYS U 7 6 ASN W Protein S 3 FT #SUB 281 280 ILE U 7 6 ASN W Protein S 1 FT #SUB 281 280 ILE U 10 9 LEU W Protein S 5 FT #SUB 281 280 ILE U 11 10 SER W Protein S 1 FT #SUB 284 283 SER U 4 3 LEU W Protein S 2 FT #SUB 284 283 SER U 7 6 ASN W Protein S 2 FT #SUB 297 296 THR U 311 310 ARG W Protein B 3 FT #SUB 298 297 GLN U 309 308 PRO W Protein S 1 FT #SUB 298 297 GLN U 310 309 THR W Protein S 10 FT #SUB 298 297 GLN U 311 310 ARG W Protein A 17 FT #SUB 298 297 GLN U 312 311 ALA W Protein B 3 FT #SUB 299 298 MET U 312 311 ALA W Protein B 1 FT #SUB 310 309 THR U 298 297 GLN W Protein B 4 FT #SUB 310 309 THR U 313 312 GLU W Protein S 1 FT #SUB 311 310 ARG U 263 262 ARG W Protein S 2 FT #SUB 311 310 ARG U 264 263 GLY W Protein S 3 FT #SUB 311 310 ARG U 297 296 THR W Protein S 3 FT #SUB 311 310 ARG U 298 297 GLN W Protein A 21 FT #SUB 312 311 ALA U 298 297 GLN W Protein A 3 FT #SUB 312 311 ALA U 299 298 MET W Protein S 1 FT #SUB 312 311 ALA U 312 311 ALA W Protein A 10 FT #SUB 312 311 ALA U 313 312 GLU W Protein A 5 FT #SUB 312 311 ALA U 316 315 ASP W Protein A 7 FT #SUB 313 312 GLU U 312 311 ALA W Protein A 6 FT #SUB 315 314 SER U 316 315 ASP W Protein S 7 FT #SUB 316 315 ASP U 311 310 ARG W Protein S 2 FT #SUB 316 315 ASP U 312 311 ALA W Protein S 11 FT #SUB 316 315 ASP U 315 314 SER W Protein A 6 FT #SUB 319 318 ASN U 319 318 ASN W Protein S 15 FT #SUB 353 352 GLU U 273 272 GLU W Protein S 16 FT #SUB 353 352 GLU U 274 273 LYS W Protein S 2 FT #SUB 366 365 SER U 4 3 LEU W Protein A 3 FT #SUB 367 366 ILE U 4 3 LEU W Protein B 1 FT #SUB 370 369 LEU U 4 3 LEU W Protein S 1 FT #HET 400 399 LEU U 21 700 FDP U A 11 FT #HET 401 400 SER U 21 700 FDP U A 9 FT #HET 402 401 ASN U 21 700 FDP U A 12 FT #HET 403 402 THR U 21 700 FDP U A 11 FT #HET 405 404 ARG U 21 700 FDP U A 4 FT #HET 406 405 SER U 21 700 FDP U A 7 FT #HET 454 453 LYS U 21 700 FDP U S 8 FT #HET 457 456 ARG U 21 700 FDP U S 9 FT #HET 480 479 ILE U 21 700 FDP U B 1 FT #HET 481 480 HIS U 21 700 FDP U A 3 FT #HET 482 481 ALA U 21 700 FDP U A 4 FT #HET 487 486 LYS U 21 700 FDP U B 1 FT #HET 488 487 GLY U 21 700 FDP U B 1 FT #HET 489 488 TYR U 21 700 FDP U B 2 FT #HET 490 489 ALA U 21 700 FDP U S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQV STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 58 57 HIS V 499 498 GLU C Protein S 1 FT #SUB 192 191 ALA V 473 472 THR C Protein S 2 FT #SUB 192 191 ALA V 474 473 GLY C Protein A 3 FT #SUB 196 195 VAL V 497 496 LEU C Protein A 7 FT #SUB 196 195 VAL V 498 497 VAL C Protein S 1 FT #SUB 196 195 VAL V 499 498 GLU C Protein S 2 FT #SUB 199 198 GLN V 487 486 LYS P Protein S 1 FT #SUB 229 228 PRO V 405 404 ARG P Protein S 4 FT #SUB 230 229 LYS V 487 486 LYS P Protein S 1 FT #SUB 230 229 LYS V 488 487 GLY P Protein S 14 FT #SUB 232 231 ARG V 232 231 ARG P Protein S 2 FT #SUB 405 404 ARG V 229 228 PRO P Protein S 2 FT #SUB 487 486 LYS V 199 198 GLN P Protein B 2 FT #SUB 488 487 GLY V 230 229 LYS P Protein B 8 FT #SUB 373 372 ILE V 390 389 TYR U Protein S 1 FT #SUB 373 372 ILE V 391 390 GLU U Protein S 1 FT #SUB 374 373 PRO V 391 390 GLU U Protein A 7 FT #SUB 374 373 PRO V 392 391 THR U Protein S 4 FT #SUB 374 373 PRO V 393 392 LYS U Protein S 3 FT #SUB 375 374 MET V 391 390 GLU U Protein A 4 FT #SUB 377 376 ALA V 495 494 ILE U Protein A 3 FT #SUB 380 379 ALA V 388 387 SER U Protein S 1 FT #SUB 380 379 ALA V 391 390 GLU U Protein A 8 FT #SUB 383 382 SER V 391 390 GLU U Protein S 1 FT #SUB 384 383 SER V 384 383 SER U Protein S 4 FT #SUB 384 383 SER V 387 386 ASN U Protein S 1 FT #SUB 388 387 SER V 380 379 ALA U Protein S 1 FT #SUB 390 389 TYR V 373 372 ILE U Protein B 2 FT #SUB 391 390 GLU V 373 372 ILE U Protein A 19 FT #SUB 391 390 GLU V 374 373 PRO U Protein B 6 FT #SUB 391 390 GLU V 375 374 MET U Protein A 5 FT #SUB 392 391 THR V 374 373 PRO U Protein A 7 FT #SUB 483 482 ASP V 494 493 ARG U Protein S 7 FT #SUB 484 483 HIS V 484 483 HIS U Protein S 4 FT #SUB 491 490 ASN V 493 492 THR U Protein B 3 FT #SUB 491 490 ASN V 494 493 ARG U Protein A 4 FT #SUB 492 491 GLN V 492 491 GLN U Protein S 9 FT #SUB 492 491 GLN V 493 492 THR U Protein A 3 FT #SUB 493 492 THR V 491 490 ASN U Protein B 1 FT #SUB 494 493 ARG V 483 482 ASP U Protein S 2 FT #SUB 494 493 ARG V 491 490 ASN U Protein A 3 FT #SUB 495 494 ILE V 377 376 ALA U Protein S 3 FT #SUB 495 494 ILE V 380 379 ALA U Protein S 1 FT #SUB 2 1 SER V 370 369 LEU X Protein S 1 FT #SUB 3 2 GLN V 280 279 LYS X Protein S 1 FT #SUB 4 3 LEU V 284 283 SER X Protein A 6 FT #SUB 4 3 LEU V 288 287 VAL X Protein S 2 FT #SUB 4 3 LEU V 367 366 ILE X Protein S 1 FT #SUB 4 3 LEU V 370 369 LEU X Protein S 2 FT #SUB 5 4 ALA V 370 369 LEU X Protein A 4 FT #SUB 7 6 ASN V 280 279 LYS X Protein S 5 FT #SUB 7 6 ASN V 281 280 ILE X Protein B 6 FT #SUB 7 6 ASN V 284 283 SER X Protein S 5 FT #SUB 8 7 LEU V 285 284 LYS X Protein A 8 FT #SUB 10 9 LEU V 277 276 VAL X Protein S 1 FT #SUB 10 9 LEU V 281 280 ILE X Protein A 7 FT #SUB 12 11 ILE V 246 245 VAL X Protein S 1 FT #SUB 12 11 ILE V 270 269 ILE X Protein S 1 FT #SUB 12 11 ILE V 274 273 LYS X Protein A 5 FT #SUB 13 12 PHE V 243 242 HIS X Protein S 11 FT #SUB 243 242 HIS V 13 12 PHE X Protein S 9 FT #SUB 270 269 ILE V 12 11 ILE X Protein S 2 FT #SUB 273 272 GLU V 353 352 GLU X Protein A 12 FT #SUB 274 273 LYS V 12 11 ILE X Protein S 13 FT #SUB 274 273 LYS V 353 352 GLU X Protein S 5 FT #SUB 276 275 VAL V 318 317 ALA X Protein S 1 FT #SUB 276 275 VAL V 322 321 PHE X Protein S 2 FT #SUB 277 276 VAL V 10 9 LEU X Protein S 3 FT #SUB 277 276 VAL V 357 356 ALA X Protein S 1 FT #SUB 280 279 LYS V 3 2 GLN X Protein S 3 FT #SUB 280 279 LYS V 7 6 ASN X Protein A 15 FT #SUB 281 280 ILE V 7 6 ASN X Protein A 11 FT #SUB 281 280 ILE V 8 7 LEU X Protein A 2 FT #SUB 281 280 ILE V 10 9 LEU X Protein S 5 FT #SUB 284 283 SER V 4 3 LEU X Protein A 21 FT #SUB 284 283 SER V 7 6 ASN X Protein S 4 FT #SUB 285 284 LYS V 8 7 LEU X Protein A 8 FT #SUB 287 286 ASN V 4 3 LEU X Protein S 2 FT #SUB 288 287 VAL V 4 3 LEU X Protein S 1 FT #SUB 298 297 GLN V 310 309 THR X Protein S 7 FT #SUB 298 297 GLN V 311 310 ARG X Protein S 6 FT #SUB 298 297 GLN V 312 311 ALA X Protein B 2 FT #SUB 311 310 ARG V 263 262 ARG X Protein S 2 FT #SUB 311 310 ARG V 264 263 GLY X Protein S 1 FT #SUB 311 310 ARG V 298 297 GLN X Protein A 11 FT #SUB 312 311 ALA V 298 297 GLN X Protein S 1 FT #SUB 312 311 ALA V 312 311 ALA X Protein A 5 FT #SUB 312 311 ALA V 313 312 GLU X Protein S 3 FT #SUB 312 311 ALA V 316 315 ASP X Protein A 6 FT #SUB 313 312 GLU V 312 311 ALA X Protein A 3 FT #SUB 314 313 VAL V 272 271 ALA X Protein S 1 FT #SUB 315 314 SER V 276 275 VAL X Protein B 1 FT #SUB 315 314 SER V 316 315 ASP X Protein S 2 FT #SUB 316 315 ASP V 315 314 SER X Protein S 3 FT #SUB 318 317 ALA V 276 275 VAL X Protein S 2 FT #SUB 319 318 ASN V 319 318 ASN X Protein S 7 FT #SUB 322 321 PHE V 276 275 VAL X Protein S 1 FT #SUB 322 321 PHE V 280 279 LYS X Protein S 1 FT #SUB 349 348 ARG V 273 272 GLU X Protein S 6 FT #SUB 350 349 ILE V 273 272 GLU X Protein A 2 FT #SUB 353 352 GLU V 273 272 GLU X Protein S 5 FT #SUB 353 352 GLU V 274 273 LYS X Protein S 7 FT #SUB 353 352 GLU V 277 276 VAL X Protein S 1 FT #SUB 370 369 LEU V 2 1 SER X Protein S 1 FT #HET 230 229 LYS V 16 700 FDP P S 1 FT #HET 400 399 LEU V 22 700 FDP V A 12 FT #HET 401 400 SER V 22 700 FDP V A 10 FT #HET 402 401 ASN V 22 700 FDP V A 12 FT #HET 403 402 THR V 22 700 FDP V A 11 FT #HET 405 404 ARG V 22 700 FDP V A 4 FT #HET 406 405 SER V 22 700 FDP V A 7 FT #HET 454 453 LYS V 22 700 FDP V S 9 FT #HET 457 456 ARG V 22 700 FDP V S 11 FT #HET 480 479 ILE V 22 700 FDP V B 1 FT #HET 481 480 HIS V 22 700 FDP V A 4 FT #HET 482 481 ALA V 22 700 FDP V A 4 FT #HET 488 487 GLY V 22 700 FDP V B 1 FT #HET 490 489 ALA V 22 700 FDP V S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQW STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 4 3 LEU W 284 283 SER U Protein S 2 FT #SUB 4 3 LEU W 366 365 SER U Protein S 3 FT #SUB 4 3 LEU W 367 366 ILE U Protein S 1 FT #SUB 4 3 LEU W 370 369 LEU U Protein S 1 FT #SUB 7 6 ASN W 280 279 LYS U Protein S 3 FT #SUB 7 6 ASN W 281 280 ILE U Protein B 1 FT #SUB 7 6 ASN W 284 283 SER U Protein S 2 FT #SUB 10 9 LEU W 277 276 VAL U Protein S 1 FT #SUB 10 9 LEU W 281 280 ILE U Protein A 5 FT #SUB 11 10 SER W 277 276 VAL U Protein B 2 FT #SUB 11 10 SER W 281 280 ILE U Protein B 1 FT #SUB 12 11 ILE W 246 245 VAL U Protein S 1 FT #SUB 12 11 ILE W 270 269 ILE U Protein S 1 FT #SUB 12 11 ILE W 274 273 LYS U Protein A 3 FT #SUB 12 11 ILE W 277 276 VAL U Protein B 1 FT #SUB 12 11 ILE W 278 277 ALA U Protein S 3 FT #SUB 13 12 PHE W 243 242 HIS U Protein S 10 FT #SUB 243 242 HIS W 13 12 PHE U Protein S 7 FT #SUB 263 262 ARG W 311 310 ARG U Protein A 2 FT #SUB 264 263 GLY W 311 310 ARG U Protein B 3 FT #SUB 270 269 ILE W 12 11 ILE U Protein S 1 FT #SUB 273 272 GLU W 353 352 GLU U Protein A 16 FT #SUB 274 273 LYS W 12 11 ILE U Protein A 18 FT #SUB 274 273 LYS W 353 352 GLU U Protein S 2 FT #SUB 277 276 VAL W 10 9 LEU U Protein S 2 FT #SUB 277 276 VAL W 11 10 SER U Protein S 2 FT #SUB 277 276 VAL W 12 11 ILE U Protein S 1 FT #SUB 280 279 LYS W 3 2 GLN U Protein S 2 FT #SUB 280 279 LYS W 7 6 ASN U Protein S 8 FT #SUB 281 280 ILE W 7 6 ASN U Protein S 2 FT #SUB 281 280 ILE W 10 9 LEU U Protein S 3 FT #SUB 284 283 SER W 4 3 LEU U Protein S 2 FT #SUB 284 283 SER W 7 6 ASN U Protein S 1 FT #SUB 285 284 LYS W 8 7 LEU U Protein S 1 FT #SUB 297 296 THR W 311 310 ARG U Protein B 3 FT #SUB 298 297 GLN W 310 309 THR U Protein S 4 FT #SUB 298 297 GLN W 311 310 ARG U Protein S 21 FT #SUB 298 297 GLN W 312 311 ALA U Protein B 3 FT #SUB 299 298 MET W 312 311 ALA U Protein B 1 FT #SUB 309 308 PRO W 298 297 GLN U Protein B 1 FT #SUB 310 309 THR W 298 297 GLN U Protein A 10 FT #SUB 311 310 ARG W 263 262 ARG U Protein S 12 FT #SUB 311 310 ARG W 264 263 GLY U Protein S 7 FT #SUB 311 310 ARG W 297 296 THR U Protein S 3 FT #SUB 311 310 ARG W 298 297 GLN U Protein A 17 FT #SUB 311 310 ARG W 316 315 ASP U Protein B 2 FT #SUB 312 311 ALA W 298 297 GLN U Protein A 3 FT #SUB 312 311 ALA W 299 298 MET U Protein S 1 FT #SUB 312 311 ALA W 312 311 ALA U Protein A 10 FT #SUB 312 311 ALA W 313 312 GLU U Protein S 6 FT #SUB 312 311 ALA W 316 315 ASP U Protein A 11 FT #SUB 313 312 GLU W 310 309 THR U Protein S 1 FT #SUB 313 312 GLU W 312 311 ALA U Protein A 5 FT #SUB 315 314 SER W 316 315 ASP U Protein S 6 FT #SUB 316 315 ASP W 312 311 ALA U Protein S 7 FT #SUB 316 315 ASP W 315 314 SER U Protein A 7 FT #SUB 319 318 ASN W 319 318 ASN U Protein S 15 FT #SUB 349 348 ARG W 273 272 GLU U Protein A 6 FT #SUB 353 352 GLU W 273 272 GLU U Protein S 12 FT #SUB 353 352 GLU W 274 273 LYS U Protein S 2 FT #SUB 353 352 GLU W 277 276 VAL U Protein S 1 FT #SUB 370 369 LEU W 4 3 LEU U Protein S 1 FT #SUB 368 367 LYS W 387 386 ASN X Protein S 1 FT #SUB 368 367 LYS W 391 390 GLU X Protein S 1 FT #SUB 373 372 ILE W 390 389 TYR X Protein S 1 FT #SUB 373 372 ILE W 391 390 GLU X Protein A 18 FT #SUB 374 373 PRO W 391 390 GLU X Protein A 5 FT #SUB 374 373 PRO W 392 391 THR X Protein A 8 FT #SUB 375 374 MET W 391 390 GLU X Protein S 4 FT #SUB 377 376 ALA W 495 494 ILE X Protein A 4 FT #SUB 380 379 ALA W 388 387 SER X Protein S 1 FT #SUB 380 379 ALA W 495 494 ILE X Protein S 1 FT #SUB 384 383 SER W 384 383 SER X Protein A 5 FT #SUB 387 386 ASN W 384 383 SER X Protein S 1 FT #SUB 391 390 GLU W 374 373 PRO X Protein B 5 FT #SUB 391 390 GLU W 375 374 MET X Protein A 4 FT #SUB 391 390 GLU W 380 379 ALA X Protein S 9 FT #SUB 391 390 GLU W 383 382 SER X Protein S 2 FT #SUB 392 391 THR W 374 373 PRO X Protein B 3 FT #SUB 392 391 THR W 377 376 ALA X Protein S 1 FT #SUB 393 392 LYS W 374 373 PRO X Protein S 3 FT #SUB 483 482 ASP W 494 493 ARG X Protein S 3 FT #SUB 484 483 HIS W 484 483 HIS X Protein S 4 FT #SUB 491 490 ASN W 493 492 THR X Protein B 1 FT #SUB 491 490 ASN W 494 493 ARG X Protein B 3 FT #SUB 492 491 GLN W 492 491 GLN X Protein S 11 FT #SUB 493 492 THR W 491 490 ASN X Protein B 3 FT #SUB 493 492 THR W 492 491 GLN X Protein B 3 FT #SUB 493 492 THR W 493 492 THR X Protein B 1 FT #SUB 494 493 ARG W 483 482 ASP X Protein S 8 FT #SUB 494 493 ARG W 491 490 ASN X Protein A 4 FT #SUB 495 494 ILE W 377 376 ALA X Protein S 5 FT #SUB 495 494 ILE W 491 490 ASN X Protein B 3 FT #HET 400 399 LEU W 23 700 FDP W A 12 FT #HET 401 400 SER W 23 700 FDP W A 10 FT #HET 402 401 ASN W 23 700 FDP W A 12 FT #HET 403 402 THR W 23 700 FDP W A 11 FT #HET 405 404 ARG W 23 700 FDP W A 4 FT #HET 406 405 SER W 23 700 FDP W A 7 FT #HET 454 453 LYS W 23 700 FDP W S 9 FT #HET 457 456 ARG W 23 700 FDP W S 11 FT #HET 480 479 ILE W 23 700 FDP W B 1 FT #HET 481 480 HIS W 23 700 FDP W A 4 FT #HET 482 481 ALA W 23 700 FDP W A 4 FT #HET 488 487 GLY W 23 700 FDP W B 1 FT #HET 490 489 ALA W 23 700 FDP W S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE // ID 3HQQX STANDARD; PRT; 499 AA. DT CONVERTED FROM PDB (SEQRES) 3HQQ DE Pyruvate kinase OS Leishmania mexicana CC EXPDTA X-RAY DIFFRACTION CC RESOLU 5.070 CC R-Factor 0.353 FT #SUB 2 1 SER X 370 369 LEU V Protein S 1 FT #SUB 3 2 GLN X 280 279 LYS V Protein S 3 FT #SUB 4 3 LEU X 284 283 SER V Protein A 21 FT #SUB 4 3 LEU X 287 286 ASN V Protein S 2 FT #SUB 4 3 LEU X 288 287 VAL V Protein S 1 FT #SUB 7 6 ASN X 280 279 LYS V Protein S 15 FT #SUB 7 6 ASN X 281 280 ILE V Protein A 11 FT #SUB 7 6 ASN X 284 283 SER V Protein S 4 FT #SUB 8 7 LEU X 281 280 ILE V Protein A 2 FT #SUB 8 7 LEU X 285 284 LYS V Protein S 8 FT #SUB 10 9 LEU X 277 276 VAL V Protein S 3 FT #SUB 10 9 LEU X 281 280 ILE V Protein A 5 FT #SUB 12 11 ILE X 270 269 ILE V Protein S 2 FT #SUB 12 11 ILE X 274 273 LYS V Protein A 13 FT #SUB 13 12 PHE X 243 242 HIS V Protein S 9 FT #SUB 243 242 HIS X 13 12 PHE V Protein S 11 FT #SUB 246 245 VAL X 12 11 ILE V Protein S 1 FT #SUB 263 262 ARG X 311 310 ARG V Protein A 2 FT #SUB 264 263 GLY X 311 310 ARG V Protein B 1 FT #SUB 270 269 ILE X 12 11 ILE V Protein S 1 FT #SUB 272 271 ALA X 314 313 VAL V Protein B 1 FT #SUB 273 272 GLU X 349 348 ARG V Protein S 6 FT #SUB 273 272 GLU X 350 349 ILE V Protein S 2 FT #SUB 273 272 GLU X 353 352 GLU V Protein A 5 FT #SUB 274 273 LYS X 12 11 ILE V Protein S 5 FT #SUB 274 273 LYS X 353 352 GLU V Protein S 7 FT #SUB 276 275 VAL X 315 314 SER V Protein S 1 FT #SUB 276 275 VAL X 318 317 ALA V Protein S 2 FT #SUB 276 275 VAL X 322 321 PHE V Protein S 1 FT #SUB 277 276 VAL X 10 9 LEU V Protein S 1 FT #SUB 277 276 VAL X 353 352 GLU V Protein S 1 FT #SUB 280 279 LYS X 3 2 GLN V Protein S 1 FT #SUB 280 279 LYS X 7 6 ASN V Protein A 5 FT #SUB 280 279 LYS X 322 321 PHE V Protein S 1 FT #SUB 281 280 ILE X 7 6 ASN V Protein A 6 FT #SUB 281 280 ILE X 10 9 LEU V Protein S 7 FT #SUB 284 283 SER X 4 3 LEU V Protein A 6 FT #SUB 284 283 SER X 7 6 ASN V Protein S 5 FT #SUB 285 284 LYS X 8 7 LEU V Protein A 8 FT #SUB 288 287 VAL X 4 3 LEU V Protein S 2 FT #SUB 298 297 GLN X 311 310 ARG V Protein S 11 FT #SUB 298 297 GLN X 312 311 ALA V Protein B 1 FT #SUB 310 309 THR X 298 297 GLN V Protein A 7 FT #SUB 311 310 ARG X 298 297 GLN V Protein A 6 FT #SUB 312 311 ALA X 298 297 GLN V Protein A 2 FT #SUB 312 311 ALA X 312 311 ALA V Protein A 5 FT #SUB 312 311 ALA X 313 312 GLU V Protein S 3 FT #SUB 313 312 GLU X 312 311 ALA V Protein A 3 FT #SUB 315 314 SER X 316 315 ASP V Protein S 3 FT #SUB 316 315 ASP X 312 311 ALA V Protein S 6 FT #SUB 316 315 ASP X 315 314 SER V Protein S 2 FT #SUB 318 317 ALA X 276 275 VAL V Protein S 1 FT #SUB 319 318 ASN X 319 318 ASN V Protein S 7 FT #SUB 322 321 PHE X 276 275 VAL V Protein S 2 FT #SUB 353 352 GLU X 273 272 GLU V Protein S 12 FT #SUB 353 352 GLU X 274 273 LYS V Protein S 5 FT #SUB 357 356 ALA X 277 276 VAL V Protein S 1 FT #SUB 367 366 ILE X 4 3 LEU V Protein S 1 FT #SUB 370 369 LEU X 2 1 SER V Protein S 1 FT #SUB 370 369 LEU X 4 3 LEU V Protein S 2 FT #SUB 370 369 LEU X 5 4 ALA V Protein S 4 FT #SUB 374 373 PRO X 391 390 GLU W Protein A 5 FT #SUB 374 373 PRO X 392 391 THR W Protein S 3 FT #SUB 374 373 PRO X 393 392 LYS W Protein S 3 FT #SUB 375 374 MET X 391 390 GLU W Protein A 4 FT #SUB 377 376 ALA X 392 391 THR W Protein B 1 FT #SUB 377 376 ALA X 495 494 ILE W Protein A 5 FT #SUB 380 379 ALA X 391 390 GLU W Protein A 9 FT #SUB 383 382 SER X 391 390 GLU W Protein S 2 FT #SUB 384 383 SER X 384 383 SER W Protein S 5 FT #SUB 384 383 SER X 387 386 ASN W Protein S 1 FT #SUB 387 386 ASN X 368 367 LYS W Protein S 1 FT #SUB 388 387 SER X 380 379 ALA W Protein S 1 FT #SUB 390 389 TYR X 373 372 ILE W Protein B 1 FT #SUB 391 390 GLU X 368 367 LYS W Protein S 1 FT #SUB 391 390 GLU X 373 372 ILE W Protein A 18 FT #SUB 391 390 GLU X 374 373 PRO W Protein B 5 FT #SUB 391 390 GLU X 375 374 MET W Protein S 4 FT #SUB 392 391 THR X 374 373 PRO W Protein A 8 FT #SUB 483 482 ASP X 494 493 ARG W Protein S 8 FT #SUB 484 483 HIS X 484 483 HIS W Protein S 4 FT #SUB 491 490 ASN X 493 492 THR W Protein B 3 FT #SUB 491 490 ASN X 494 493 ARG W Protein A 4 FT #SUB 491 490 ASN X 495 494 ILE W Protein A 3 FT #SUB 492 491 GLN X 492 491 GLN W Protein S 11 FT #SUB 492 491 GLN X 493 492 THR W Protein A 3 FT #SUB 493 492 THR X 491 490 ASN W Protein B 1 FT #SUB 493 492 THR X 493 492 THR W Protein B 1 FT #SUB 494 493 ARG X 483 482 ASP W Protein S 3 FT #SUB 494 493 ARG X 491 490 ASN W Protein A 3 FT #SUB 495 494 ILE X 377 376 ALA W Protein A 4 FT #SUB 495 494 ILE X 380 379 ALA W Protein S 1 FT #HET 400 399 LEU X 24 700 FDP X A 12 FT #HET 401 400 SER X 24 700 FDP X A 10 FT #HET 402 401 ASN X 24 700 FDP X A 12 FT #HET 403 402 THR X 24 700 FDP X A 11 FT #HET 405 404 ARG X 24 700 FDP X A 4 FT #HET 406 405 SER X 24 700 FDP X A 7 FT #HET 454 453 LYS X 24 700 FDP X S 9 FT #HET 457 456 ARG X 24 700 FDP X S 11 FT #HET 480 479 ILE X 24 700 FDP X B 1 FT #HET 481 480 HIS X 24 700 FDP X A 4 FT #HET 482 481 ALA X 24 700 FDP X A 4 FT #HET 488 487 GLY X 24 700 FDP X B 1 FT #HET 490 489 ALA X 24 700 FDP X S 1 FT DISORDER 1 1 CC SEQUENCE 498 AA (ATOM); CC SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM NFSHGSHEYH CC QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV MERGATCYVT TDPAFADKGT CC KDKFYIDYQN LSKVVRPGNY IYIDDGILIL QVQSHEDEQT LECTVTNSHT ISDRRGVNLP CC GCDVDLPAVS AKDRVDLQFG VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE CC NHQGVQNIDS IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE CC SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC LEAQSALNEY CC VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS NTGRSARLVA KYRPNCPIVC CC VTTRLQTCRQ LNITQGVESV FFDADKLGHD EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH CC ADHKVKGYAN QTRILLVE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ATOM -SQLAHNLTLSIFDPVANYRAARIICTIGPSTQSVEALKGLIQSGMSVAR CC ************************************************* CC SEQRES MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ATOM MNFSHGSHEYHQTTINNVRQAAAELGVNIAIALDTKGPEIRTGQFVGGDA CC ************************************************** CC SEQRES VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ATOM VMERGATCYVTTDPAFADKGTKDKFYIDYQNLSKVVRPGNYIYIDDGILI CC ************************************************** CC SEQRES LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ATOM LQVQSHEDEQTLECTVTNSHTISDRRGVNLPGCDVDLPAVSAKDRVDLQF CC ************************************************** CC SEQRES GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ATOM GVEQGVDMIFASFIRSAEQVGDVRKALGPKGRDIMIICKIENHQGVQNID CC ************************************************** CC SEQRES SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ATOM SIIEESDGIMVARGDLGVEIPAEKVVVAQKILISKCNVAGKPVICATQML CC ************************************************** CC SEQRES ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ATOM ESMTYNPRPTRAEVSDVANAVFNGADCVMLSGETAKGKYPNEVVQYMARI CC ************************************************** CC SEQRES CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ATOM CLEAQSALNEYVFFNSIKKLQHIPMSADEAVCSSAVNSVYETKAKAMVVL CC ************************************************** CC SEQRES SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ATOM SNTGRSARLVAKYRPNCPIVCVTTRLQTCRQLNITQGVESVFFDADKLGH CC ************************************************** CC SEQRES DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ATOM DEGKEHRVAAGVEFAKSKGYVQTGDYCVVIHADHKVKGYANQTRILLVE CC ************************************************* SQ SEQUENCE 499 AA; MW; CN; MSQLAHNLTL SIFDPVANYR AARIICTIGP STQSVEALKG LIQSGMSVAR MNFSHGSHEY HQTTINNVRQ AAAELGVNIA IALDTKGPEI RTGQFVGGDA VMERGATCYV TTDPAFADKG TKDKFYIDYQ NLSKVVRPGN YIYIDDGILI LQVQSHEDEQ TLECTVTNSH TISDRRGVNL PGCDVDLPAV SAKDRVDLQF GVEQGVDMIF ASFIRSAEQV GDVRKALGPK GRDIMIICKI ENHQGVQNID SIIEESDGIM VARGDLGVEI PAEKVVVAQK ILISKCNVAG KPVICATQML ESMTYNPRPT RAEVSDVANA VFNGADCVML SGETAKGKYP NEVVQYMARI CLEAQSALNE YVFFNSIKKL QHIPMSADEA VCSSAVNSVY ETKAKAMVVL SNTGRSARLV AKYRPNCPIV CVTTRLQTCR QLNITQGVES VFFDADKLGH DEGKEHRVAA GVEFAKSKGY VQTGDYCVVI HADHKVKGYA NQTRILLVE //