ID 2ONGA STANDARD; PRT; 543 AA. DT CONVERTED FROM PDB (SEQRES) 2ONG DE 4S-limonene synthase OS Mentha spicata CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.208 FT #SUB 241 297 GLU A 244 300 ARG B Protein S 1 FT #SUB 244 300 ARG A 241 297 GLU B Protein S 1 FT #SUB 244 300 ARG A 244 300 ARG B Protein S 11 FT #SUB 248 304 ASN A 346 402 TYR B Protein B 1 FT #SUB 248 304 ASN A 350 406 LYS B Protein B 3 FT #SUB 249 305 THR A 346 402 TYR B Protein B 5 FT #SUB 251 307 PHE A 346 402 TYR B Protein S 3 FT #SUB 254 310 LYS A 350 406 LYS B Protein S 4 FT #SUB 320 376 ILE A 357 413 ILE B Protein A 2 FT #SUB 320 376 ILE A 361 417 ARG B Protein S 1 FT #SUB 321 377 ASN A 361 417 ARG B Protein S 1 FT #SUB 323 379 ILE A 355 411 ASN B Protein S 2 FT #SUB 324 380 ASP A 355 411 ASN B Protein S 4 FT #SUB 331 387 GLN A 349 405 MET B Protein S 1 FT #SUB 332 388 LEU A 346 402 TYR B Protein A 11 FT #SUB 332 388 LEU A 349 405 MET B Protein S 1 FT #SUB 335 391 LEU A 342 398 ASP B Protein S 1 FT #SUB 335 391 LEU A 346 402 TYR B Protein S 6 FT #SUB 335 391 LEU A 349 405 MET B Protein S 2 FT #SUB 336 392 ALA A 346 402 TYR B Protein A 3 FT #SUB 338 394 ASN A 342 398 ASP B Protein S 2 FT #SUB 339 395 ASN A 342 398 ASP B Protein S 8 FT #SUB 339 395 ASN A 343 399 ASP B Protein S 1 FT #SUB 339 395 ASN A 346 402 TYR B Protein S 1 FT #SUB 342 398 ASP A 338 394 ASN B Protein S 1 FT #SUB 342 398 ASP A 339 395 ASN B Protein A 5 FT #SUB 342 398 ASP A 342 398 ASP B Protein S 1 FT #SUB 343 399 ASP A 339 395 ASN B Protein B 2 FT #SUB 346 402 TYR A 248 304 ASN B Protein S 1 FT #SUB 346 402 TYR A 249 305 THR B Protein S 5 FT #SUB 346 402 TYR A 251 307 PHE B Protein S 1 FT #SUB 346 402 TYR A 332 388 LEU B Protein S 9 FT #SUB 346 402 TYR A 335 391 LEU B Protein A 5 FT #SUB 346 402 TYR A 336 392 ALA B Protein S 5 FT #SUB 346 402 TYR A 339 395 ASN B Protein S 1 FT #SUB 349 405 MET A 331 387 GLN B Protein S 4 FT #SUB 349 405 MET A 332 388 LEU B Protein S 5 FT #SUB 350 406 LYS A 248 304 ASN B Protein S 3 FT #SUB 350 406 LYS A 254 310 LYS B Protein B 3 FT #SUB 355 411 ASN A 323 379 ILE B Protein S 2 FT #SUB 355 411 ASN A 324 380 ASP B Protein S 5 FT #SUB 357 413 ILE A 320 376 ILE B Protein S 2 FT #SUB 361 417 ARG A 320 376 ILE B Protein S 1 FT #HET 170 226 GLU A 6 605 BTB A S 2 FT #HET 259 315 ARG A 4 600 FPG A S 7 FT #HET 265 321 CYS A 4 600 FPG A S 1 FT #HET 268 324 TRP A 4 600 FPG A S 2 FT #HET 289 345 ASN A 4 600 FPG A A 8 FT #HET 292 348 ILE A 4 600 FPG A S 1 FT #HET 293 349 THR A 4 600 FPG A B 1 FT #HET 296 352 ASP A 1 601 MN A S 3 FT #HET 296 352 ASP A 2 602 MN A S 3 FT #HET 296 352 ASP A 4 600 FPG A S 6 FT #HET 300 356 ASP A 1 601 MN A S 3 FT #HET 300 356 ASP A 2 602 MN A S 3 FT #HET 300 356 ASP A 4 600 FPG A S 2 FT #HET 371 427 TYR A 4 600 FPG A S 1 FT #HET 374 430 GLU A 1 601 MN A S 1 FT #HET 387 443 GLU A 5 604 BTB A S 8 FT #HET 390 446 LEU A 5 604 BTB A S 2 FT #HET 397 453 ILE A 4 600 FPG A B 2 FT #HET 402 458 MET A 4 600 FPG A S 2 FT #HET 430 486 ARG A 5 604 BTB A S 2 FT #HET 434 490 PHE A 5 604 BTB A S 9 FT #HET 437 493 ARG A 4 600 FPG A S 1 FT #HET 440 496 ASP A 3 603 MN A S 3 FT #HET 440 496 ASP A 4 600 FPG A S 6 FT #HET 444 500 THR A 3 603 MN A S 3 FT #HET 444 500 THR A 4 600 FPG A S 1 FT #HET 451 507 ARG A 2 602 MN A S 1 FT #HET 453 509 ASP A 1 601 MN A S 1 FT #HET 453 509 ASP A 2 602 MN A S 1 FT #HET 453 509 ASP A 4 600 FPG A S 1 FT #HET 456 512 LYS A 4 600 FPG A S 1 FT #HET 479 535 LEU A 5 604 BTB A S 2 FT #HET 482 538 GLU A 5 604 BTB A S 2 FT #HET 486 542 LYS A 5 604 BTB A S 4 FT #HET 517 573 TYR A 4 600 FPG A S 3 FT #HET 523 579 HIS A 4 600 FPG A S 6 CC Miss-BB 1 CC Miss-SC 2 CC SEQUENCE 543 AA (ATOM); CC MRRSGNYNPS RWDVNFIQSL LSDYKEDKHV IRASELVTLV KMELEKETDQ IRQLELIDDL CC QRMGLSDHFQ NEFKEILSSI YLDHHYYKNP FPKEERDLYS TSLAFRLLRE HGFQVAQEVF CC DSFKNEEGEF KESLSDDTRG LLQLYEASFL LTEGETTLES AREFATKFLE EKVNEGGVDG CC DLLTRIAYSL DIPLHWRIKR PNAPVWIEWY RKRPDMNPVV LELAILDLNI VQAQFQEELK CC ESFRWWRNTG FVEKLPFARD RLVECYFWNT GIIEPRQHAS ARIMMGKVNA LITVIDDIYD CC VYGTLEELEQ FTDLIRRWDI NSIDQLPDYM QLCFLALNNF VDDTSYDVMK EKGVNVIPYL CC RQSWVDLADK YMVEARWFYG GHKPSLEEYL ENSWQSISGP CMLTHIFFRV TDSFTKETVD CC SLYKYHDLVR WSSFVLRLAD DLGTSVEEVS RGDVPKSLQC YMSDYNASEA EARKHVKWLI CC AEVWKKMNAE RVSKDSPFGK DFIGCAVDLG RMAQLMYHNG DGHGTQHPII HQQMTRTLFE CC PFA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MRRSGNYNPSRWDVNFIQSLLSDYKEDKHVIRASELVTLVKMELEKETDQ CC ATOM MRRSGNYNPSRWDVNFIQSLLSDYKEDKHVIRASELVTLVKMELEKETDQ CC ************************************************** CC SEQRES IRQLELIDDLQRMGLSDHFQNEFKEILSSIYLDHHYYKNPFPKEERDLYS CC ATOM IRQLELIDDLQRMGLSDHFQNEFKEILSSIYLDHHYYKNPFPKEERDLYS CC ************************************************** CC SEQRES TSLAFRLLREHGFQVAQEVFDSFKNEEGEFKESLSDDTRGLLQLYEASFL CC ATOM TSLAFRLLREHGFQVAQEVFDSFKNEEGEFKESLSDDTRGLLQLYEASFL CC ************************************************** CC SEQRES LTEGETTLESAREFATKFLEEKVNEGGVDGDLLTRIAYSLDIPLHWRIKR CC ATOM LTEGETTLESAREFATKFLEEKVNEGGVDGDLLTRIAYSLDIPLHWRIKR CC ************************************************** CC SEQRES PNAPVWIEWYRKRPDMNPVVLELAILDLNIVQAQFQEELKESFRWWRNTG CC ATOM PNAPVWIEWYRKRPDMNPVVLELAILDLNIVQAQFQEELKESFRWWRNTG CC ************************************************** CC SEQRES FVEKLPFARDRLVECYFWNTGIIEPRQHASARIMMGKVNALITVIDDIYD CC ATOM FVEKLPFARDRLVECYFWNTGIIEPRQHASARIMMGKVNALITVIDDIYD CC ************************************************** CC SEQRES VYGTLEELEQFTDLIRRWDINSIDQLPDYMQLCFLALNNFVDDTSYDVMK CC ATOM VYGTLEELEQFTDLIRRWDINSIDQLPDYMQLCFLALNNFVDDTSYDVMK CC ************************************************** CC SEQRES EKGVNVIPYLRQSWVDLADKYMVEARWFYGGHKPSLEEYLENSWQSISGP CC ATOM EKGVNVIPYLRQSWVDLADKYMVEARWFYGGHKPSLEEYLENSWQSISGP CC ************************************************** CC SEQRES CMLTHIFFRVTDSFTKETVDSLYKYHDLVRWSSFVLRLADDLGTSVEEVS CC ATOM CMLTHIFFRVTDSFTKETVDSLYKYHDLVRWSSFVLRLADDLGTSVEEVS CC ************************************************** CC SEQRES RGDVPKSLQCYMSDYNASEAEARKHVKWLIAEVWKKMNAERVSKDSPFGK CC ATOM RGDVPKSLQCYMSDYNASEAEARKHVKWLIAEVWKKMNAERVSKDSPFGK CC ************************************************** CC SEQRES DFIGCAVDLGRMAQLMYHNGDGHGTQHPIIHQQMTRTLFEPFA CC ATOM DFIGCAVDLGRMAQLMYHNGDGHGTQHPIIHQQMTRTLFEPFA CC ******************************************* SQ SEQUENCE 543 AA; MW; CN; MRRSGNYNPS RWDVNFIQSL LSDYKEDKHV IRASELVTLV KMELEKETDQ IRQLELIDDL QRMGLSDHFQ NEFKEILSSI YLDHHYYKNP FPKEERDLYS TSLAFRLLRE HGFQVAQEVF DSFKNEEGEF KESLSDDTRG LLQLYEASFL LTEGETTLES AREFATKFLE EKVNEGGVDG DLLTRIAYSL DIPLHWRIKR PNAPVWIEWY RKRPDMNPVV LELAILDLNI VQAQFQEELK ESFRWWRNTG FVEKLPFARD RLVECYFWNT GIIEPRQHAS ARIMMGKVNA LITVIDDIYD VYGTLEELEQ FTDLIRRWDI NSIDQLPDYM QLCFLALNNF VDDTSYDVMK EKGVNVIPYL RQSWVDLADK YMVEARWFYG GHKPSLEEYL ENSWQSISGP CMLTHIFFRV TDSFTKETVD SLYKYHDLVR WSSFVLRLAD DLGTSVEEVS RGDVPKSLQC YMSDYNASEA EARKHVKWLI AEVWKKMNAE RVSKDSPFGK DFIGCAVDLG RMAQLMYHNG DGHGTQHPII HQQMTRTLFE PFA // ID 2ONGB STANDARD; PRT; 543 AA. DT CONVERTED FROM PDB (SEQRES) 2ONG DE 4S-limonene synthase OS Mentha spicata CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.208 FT #SUB 241 297 GLU B 244 300 ARG A Protein S 1 FT #SUB 244 300 ARG B 241 297 GLU A Protein S 1 FT #SUB 244 300 ARG B 244 300 ARG A Protein S 11 FT #SUB 248 304 ASN B 346 402 TYR A Protein B 1 FT #SUB 248 304 ASN B 350 406 LYS A Protein A 3 FT #SUB 249 305 THR B 346 402 TYR A Protein B 5 FT #SUB 251 307 PHE B 346 402 TYR A Protein S 1 FT #SUB 254 310 LYS B 350 406 LYS A Protein S 3 FT #SUB 320 376 ILE B 357 413 ILE A Protein A 2 FT #SUB 320 376 ILE B 361 417 ARG A Protein S 1 FT #SUB 323 379 ILE B 355 411 ASN A Protein S 2 FT #SUB 324 380 ASP B 355 411 ASN A Protein S 5 FT #SUB 331 387 GLN B 349 405 MET A Protein A 4 FT #SUB 332 388 LEU B 346 402 TYR A Protein A 9 FT #SUB 332 388 LEU B 349 405 MET A Protein A 5 FT #SUB 335 391 LEU B 346 402 TYR A Protein S 5 FT #SUB 336 392 ALA B 346 402 TYR A Protein A 5 FT #SUB 338 394 ASN B 342 398 ASP A Protein S 1 FT #SUB 339 395 ASN B 342 398 ASP A Protein S 5 FT #SUB 339 395 ASN B 343 399 ASP A Protein S 2 FT #SUB 339 395 ASN B 346 402 TYR A Protein S 1 FT #SUB 342 398 ASP B 335 391 LEU A Protein B 1 FT #SUB 342 398 ASP B 338 394 ASN A Protein S 2 FT #SUB 342 398 ASP B 339 395 ASN A Protein A 8 FT #SUB 342 398 ASP B 342 398 ASP A Protein S 1 FT #SUB 343 399 ASP B 339 395 ASN A Protein B 1 FT #SUB 346 402 TYR B 248 304 ASN A Protein S 1 FT #SUB 346 402 TYR B 249 305 THR A Protein S 5 FT #SUB 346 402 TYR B 251 307 PHE A Protein S 3 FT #SUB 346 402 TYR B 332 388 LEU A Protein S 11 FT #SUB 346 402 TYR B 335 391 LEU A Protein A 6 FT #SUB 346 402 TYR B 336 392 ALA A Protein S 3 FT #SUB 346 402 TYR B 339 395 ASN A Protein S 1 FT #SUB 349 405 MET B 331 387 GLN A Protein S 1 FT #SUB 349 405 MET B 332 388 LEU A Protein S 1 FT #SUB 349 405 MET B 335 391 LEU A Protein S 2 FT #SUB 350 406 LYS B 248 304 ASN A Protein S 3 FT #SUB 350 406 LYS B 254 310 LYS A Protein B 4 FT #SUB 355 411 ASN B 323 379 ILE A Protein S 2 FT #SUB 355 411 ASN B 324 380 ASP A Protein S 4 FT #SUB 357 413 ILE B 320 376 ILE A Protein S 2 FT #SUB 361 417 ARG B 320 376 ILE A Protein S 1 FT #SUB 361 417 ARG B 321 377 ASN A Protein S 1 FT #HET 162 218 ARG B 12 1605 BTB B S 1 FT #HET 259 315 ARG B 8 1602 MN B S 1 FT #HET 259 315 ARG B 10 1600 FPG B S 11 FT #HET 268 324 TRP B 10 1600 FPG B S 4 FT #HET 292 348 ILE B 10 1600 FPG B S 1 FT #HET 293 349 THR B 10 1600 FPG B A 5 FT #HET 296 352 ASP B 7 1601 MN B S 2 FT #HET 296 352 ASP B 8 1602 MN B S 3 FT #HET 296 352 ASP B 10 1600 FPG B S 8 FT #HET 300 356 ASP B 7 1601 MN B S 2 FT #HET 300 356 ASP B 8 1602 MN B S 3 FT #HET 300 356 ASP B 10 1600 FPG B S 2 FT #HET 374 430 GLU B 7 1601 MN B S 1 FT #HET 387 443 GLU B 11 1604 BTB B S 4 FT #HET 396 452 SER B 10 1600 FPG B B 1 FT #HET 397 453 ILE B 10 1600 FPG B A 3 FT #HET 430 486 ARG B 11 1604 BTB B S 1 FT #HET 437 493 ARG B 10 1600 FPG B S 7 FT #HET 440 496 ASP B 9 1603 MN B S 3 FT #HET 440 496 ASP B 10 1600 FPG B S 4 FT #HET 444 500 THR B 9 1603 MN B S 3 FT #HET 444 500 THR B 10 1600 FPG B S 2 FT #HET 456 512 LYS B 10 1600 FPG B S 1 FT #HET 474 530 LYS B 12 1605 BTB B S 1 FT #HET 479 535 LEU B 11 1604 BTB B S 6 FT #HET 482 538 GLU B 11 1604 BTB B S 1 FT #HET 486 542 LYS B 11 1604 BTB B S 2 FT #HET 517 573 TYR B 10 1600 FPG B S 3 FT #HET 523 579 HIS B 10 1600 FPG B S 13 CC Miss-BB 1 CC Miss-SC 2 CC SEQUENCE 543 AA (ATOM); CC MRRSGNYNPS RWDVNFIQSL LSDYKEDKHV IRASELVTLV KMELEKETDQ IRQLELIDDL CC QRMGLSDHFQ NEFKEILSSI YLDHHYYKNP FPKEERDLYS TSLAFRLLRE HGFQVAQEVF CC DSFKNEEGEF KESLSDDTRG LLQLYEASFL LTEGETTLES AREFATKFLE EKVNEGGVDG CC DLLTRIAYSL DIPLHWRIKR PNAPVWIEWY RKRPDMNPVV LELAILDLNI VQAQFQEELK CC ESFRWWRNTG FVEKLPFARD RLVECYFWNT GIIEPRQHAS ARIMMGKVNA LITVIDDIYD CC VYGTLEELEQ FTDLIRRWDI NSIDQLPDYM QLCFLALNNF VDDTSYDVMK EKGVNVIPYL CC RQSWVDLADK YMVEARWFYG GHKPSLEEYL ENSWQSISGP CMLTHIFFRV TDSFTKETVD CC SLYKYHDLVR WSSFVLRLAD DLGTSVEEVS RGDVPKSLQC YMSDYNASEA EARKHVKWLI CC AEVWKKMNAE RVSKDSPFGK DFIGCAVDLG RMAQLMYHNG DGHGTQHPII HQQMTRTLFE CC PFA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MRRSGNYNPSRWDVNFIQSLLSDYKEDKHVIRASELVTLVKMELEKETDQ CC ATOM MRRSGNYNPSRWDVNFIQSLLSDYKEDKHVIRASELVTLVKMELEKETDQ CC ************************************************** CC SEQRES IRQLELIDDLQRMGLSDHFQNEFKEILSSIYLDHHYYKNPFPKEERDLYS CC ATOM IRQLELIDDLQRMGLSDHFQNEFKEILSSIYLDHHYYKNPFPKEERDLYS CC ************************************************** CC SEQRES TSLAFRLLREHGFQVAQEVFDSFKNEEGEFKESLSDDTRGLLQLYEASFL CC ATOM TSLAFRLLREHGFQVAQEVFDSFKNEEGEFKESLSDDTRGLLQLYEASFL CC ************************************************** CC SEQRES LTEGETTLESAREFATKFLEEKVNEGGVDGDLLTRIAYSLDIPLHWRIKR CC ATOM LTEGETTLESAREFATKFLEEKVNEGGVDGDLLTRIAYSLDIPLHWRIKR CC ************************************************** CC SEQRES PNAPVWIEWYRKRPDMNPVVLELAILDLNIVQAQFQEELKESFRWWRNTG CC ATOM PNAPVWIEWYRKRPDMNPVVLELAILDLNIVQAQFQEELKESFRWWRNTG CC ************************************************** CC SEQRES FVEKLPFARDRLVECYFWNTGIIEPRQHASARIMMGKVNALITVIDDIYD CC ATOM FVEKLPFARDRLVECYFWNTGIIEPRQHASARIMMGKVNALITVIDDIYD CC ************************************************** CC SEQRES VYGTLEELEQFTDLIRRWDINSIDQLPDYMQLCFLALNNFVDDTSYDVMK CC ATOM VYGTLEELEQFTDLIRRWDINSIDQLPDYMQLCFLALNNFVDDTSYDVMK CC ************************************************** CC SEQRES EKGVNVIPYLRQSWVDLADKYMVEARWFYGGHKPSLEEYLENSWQSISGP CC ATOM EKGVNVIPYLRQSWVDLADKYMVEARWFYGGHKPSLEEYLENSWQSISGP CC ************************************************** CC SEQRES CMLTHIFFRVTDSFTKETVDSLYKYHDLVRWSSFVLRLADDLGTSVEEVS CC ATOM CMLTHIFFRVTDSFTKETVDSLYKYHDLVRWSSFVLRLADDLGTSVEEVS CC ************************************************** CC SEQRES RGDVPKSLQCYMSDYNASEAEARKHVKWLIAEVWKKMNAERVSKDSPFGK CC ATOM RGDVPKSLQCYMSDYNASEAEARKHVKWLIAEVWKKMNAERVSKDSPFGK CC ************************************************** CC SEQRES DFIGCAVDLGRMAQLMYHNGDGHGTQHPIIHQQMTRTLFEPFA CC ATOM DFIGCAVDLGRMAQLMYHNGDGHGTQHPIIHQQMTRTLFEPFA CC ******************************************* SQ SEQUENCE 543 AA; MW; CN; MRRSGNYNPS RWDVNFIQSL LSDYKEDKHV IRASELVTLV KMELEKETDQ IRQLELIDDL QRMGLSDHFQ NEFKEILSSI YLDHHYYKNP FPKEERDLYS TSLAFRLLRE HGFQVAQEVF DSFKNEEGEF KESLSDDTRG LLQLYEASFL LTEGETTLES AREFATKFLE EKVNEGGVDG DLLTRIAYSL DIPLHWRIKR PNAPVWIEWY RKRPDMNPVV LELAILDLNI VQAQFQEELK ESFRWWRNTG FVEKLPFARD RLVECYFWNT GIIEPRQHAS ARIMMGKVNA LITVIDDIYD VYGTLEELEQ FTDLIRRWDI NSIDQLPDYM QLCFLALNNF VDDTSYDVMK EKGVNVIPYL RQSWVDLADK YMVEARWFYG GHKPSLEEYL ENSWQSISGP CMLTHIFFRV TDSFTKETVD SLYKYHDLVR WSSFVLRLAD DLGTSVEEVS RGDVPKSLQC YMSDYNASEA EARKHVKWLI AEVWKKMNAE RVSKDSPFGK DFIGCAVDLG RMAQLMYHNG DGHGTQHPII HQQMTRTLFE PFA //