ID 4KJQA STANDARD; PRT; 446 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE H(+)/Cl(-) exchange transporter ClcA OS Escherichia coli CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 2 17 ARG A 102 117 GLU B Protein S 4 FT #SUB 2 17 ARG A 104 119 GLN B Protein S 3 FT #SUB 2 17 ARG A 194 209 ARG B Protein S 2 FT #SUB 3 18 ARG A 104 119 GLN B Protein A 3 FT #SUB 3 18 ARG A 438 453 LEU B Protein S 1 FT #SUB 3 18 ARG A 441 456 GLN B Protein S 7 FT #SUB 3 18 ARG A 442 457 GLU B Protein S 8 FT #SUB 4 19 ARG A 442 457 GLU B Protein S 3 FT #SUB 6 21 LEU A 102 117 GLU B Protein S 6 FT #SUB 6 21 LEU A 104 119 GLN B Protein S 1 FT #SUB 6 21 LEU A 438 453 LEU B Protein S 1 FT #SUB 7 22 ILE A 438 453 LEU B Protein S 4 FT #SUB 7 22 ILE A 439 454 ALA B Protein S 2 FT #SUB 7 22 ILE A 442 457 GLU B Protein S 1 FT #SUB 9 24 GLN A 193 208 PHE B Protein A 19 FT #SUB 10 25 LEU A 193 208 PHE B Protein A 3 FT #SUB 10 25 LEU A 431 446 SER B Protein A 4 FT #SUB 10 25 LEU A 434 449 LEU B Protein S 3 FT #SUB 10 25 LEU A 435 450 ALA B Protein S 1 FT #SUB 11 26 LEU A 427 442 LYS B Protein A 8 FT #SUB 13 28 ARG A 187 202 GLU B Protein S 1 FT #SUB 13 28 ARG A 188 203 GLU B Protein S 7 FT #SUB 13 28 ARG A 192 207 GLN B Protein S 8 FT #SUB 13 28 ARG A 193 208 PHE B Protein S 3 FT #SUB 13 28 ARG A 428 443 PRO B Protein A 3 FT #SUB 13 28 ARG A 431 446 SER B Protein S 2 FT #SUB 14 29 ASP A 388 403 ARG B Protein A 8 FT #SUB 14 29 ASP A 418 433 THR B Protein S 1 FT #SUB 14 29 ASP A 422 437 GLN B Protein B 4 FT #SUB 15 30 LYS A 422 437 GLN B Protein B 5 FT #SUB 16 31 THR A 422 437 GLN B Protein B 7 FT #SUB 18 33 LEU A 423 438 PHE B Protein S 1 FT #SUB 21 36 LEU A 419 434 LEU B Protein S 1 FT #SUB 21 36 LEU A 423 438 PHE B Protein S 2 FT #SUB 102 117 GLU A 6 21 LEU B Protein S 7 FT #SUB 104 119 GLN A 3 18 ARG B Protein S 4 FT #SUB 104 119 GLN A 6 21 LEU B Protein S 1 FT #SUB 178 193 PRO A 411 426 ILE B Protein S 1 FT #SUB 179 194 LEU A 395 410 ILE B Protein S 1 FT #SUB 179 194 LEU A 407 422 ILE B Protein S 2 FT #SUB 179 194 LEU A 411 426 ILE B Protein S 1 FT #SUB 183 198 LEU A 391 406 LEU B Protein S 1 FT #SUB 186 201 ILE A 391 406 LEU B Protein S 1 FT #SUB 187 202 GLU A 13 28 ARG B Protein B 1 FT #SUB 188 203 GLU A 13 28 ARG B Protein S 6 FT #SUB 192 207 GLN A 13 28 ARG B Protein S 8 FT #SUB 192 207 GLN A 195 210 TYR B Protein B 3 FT #SUB 193 208 PHE A 9 24 GLN B Protein S 17 FT #SUB 193 208 PHE A 10 25 LEU B Protein S 4 FT #SUB 193 208 PHE A 13 28 ARG B Protein S 2 FT #SUB 193 208 PHE A 195 210 TYR B Protein B 9 FT #SUB 194 209 ARG A 195 210 TYR B Protein B 6 FT #SUB 195 210 TYR A 192 207 GLN B Protein S 3 FT #SUB 195 210 TYR A 193 208 PHE B Protein S 9 FT #SUB 195 210 TYR A 194 209 ARG B Protein S 5 FT #SUB 195 210 TYR A 195 210 TYR B Protein A 3 FT #SUB 201 216 LYS A 415 430 LEU B Protein B 1 FT #SUB 201 216 LYS A 418 433 THR B Protein S 5 FT #SUB 201 216 LYS A 419 434 LEU B Protein S 1 FT #SUB 201 216 LYS A 422 437 GLN B Protein S 5 FT #SUB 204 219 PHE A 391 406 LEU B Protein S 3 FT #SUB 204 219 PHE A 411 426 ILE B Protein S 2 FT #SUB 204 219 PHE A 415 430 LEU B Protein S 3 FT #SUB 205 220 ILE A 415 430 LEU B Protein A 4 FT #SUB 205 220 ILE A 419 434 LEU B Protein S 2 FT #SUB 208 223 ILE A 411 426 ILE B Protein S 2 FT #SUB 208 223 ILE A 415 430 LEU B Protein S 3 FT #SUB 211 226 THR A 408 423 LEU B Protein S 1 FT #SUB 215 230 ARG A 234 249 LEU B Protein A 3 FT #SUB 215 230 ARG A 408 423 LEU B Protein S 6 FT #SUB 216 231 ILE A 234 249 LEU B Protein A 2 FT #SUB 234 249 LEU A 215 230 ARG B Protein S 3 FT #SUB 234 249 LEU A 216 231 ILE B Protein S 2 FT #SUB 388 403 ARG A 14 29 ASP B Protein S 7 FT #SUB 388 403 ARG A 201 216 LYS B Protein S 1 FT #SUB 391 406 LEU A 182 197 ILE B Protein S 1 FT #SUB 391 406 LEU A 186 201 ILE B Protein S 1 FT #SUB 391 406 LEU A 204 219 PHE B Protein A 4 FT #SUB 395 410 ILE A 395 410 ILE B Protein S 1 FT #SUB 399 414 GLU A 404 419 TYR B Protein A 14 FT #SUB 402 417 ASP A 404 419 TYR B Protein S 1 FT #SUB 404 419 TYR A 176 191 ASN B Protein S 1 FT #SUB 404 419 TYR A 178 193 PRO B Protein S 1 FT #SUB 404 419 TYR A 399 414 GLU B Protein S 15 FT #SUB 404 419 TYR A 402 417 ASP B Protein S 2 FT #SUB 407 422 ILE A 179 194 LEU B Protein S 1 FT #SUB 407 422 ILE A 215 230 ARG B Protein S 1 FT #SUB 408 423 LEU A 215 230 ARG B Protein S 5 FT #SUB 411 426 ILE A 178 193 PRO B Protein S 2 FT #SUB 411 426 ILE A 204 219 PHE B Protein S 2 FT #SUB 411 426 ILE A 208 223 ILE B Protein S 2 FT #SUB 412 427 ILE A 208 223 ILE B Protein S 1 FT #SUB 415 430 LEU A 204 219 PHE B Protein S 3 FT #SUB 415 430 LEU A 205 220 ILE B Protein S 4 FT #SUB 415 430 LEU A 208 223 ILE B Protein S 4 FT #SUB 418 433 THR A 14 29 ASP B Protein S 1 FT #SUB 418 433 THR A 201 216 LYS B Protein A 5 FT #SUB 419 434 LEU A 21 36 LEU B Protein S 1 FT #SUB 419 434 LEU A 201 216 LYS B Protein S 1 FT #SUB 419 434 LEU A 205 220 ILE B Protein S 2 FT #SUB 422 437 GLN A 14 29 ASP B Protein S 3 FT #SUB 422 437 GLN A 15 30 LYS B Protein S 5 FT #SUB 422 437 GLN A 16 31 THR B Protein S 7 FT #SUB 422 437 GLN A 201 216 LYS B Protein S 5 FT #SUB 423 438 PHE A 18 33 LEU B Protein S 4 FT #SUB 423 438 PHE A 21 36 LEU B Protein S 2 FT #SUB 427 442 LYS A 11 26 LEU B Protein S 5 FT #SUB 428 443 PRO A 13 28 ARG B Protein S 2 FT #SUB 431 446 SER A 10 25 LEU B Protein B 2 FT #SUB 431 446 SER A 13 28 ARG B Protein S 3 FT #SUB 434 449 LEU A 10 25 LEU B Protein S 1 FT #SUB 435 450 ALA A 10 25 LEU B Protein B 1 FT #SUB 438 453 LEU A 6 21 LEU B Protein S 1 FT #SUB 438 453 LEU A 7 22 ILE B Protein A 4 FT #SUB 439 454 ALA A 7 22 ILE B Protein B 2 FT #SUB 441 456 GLN A 3 18 ARG B Protein A 7 FT #SUB 442 457 GLU A 3 18 ARG B Protein S 5 FT #SUB 442 457 GLU A 4 19 ARG B Protein S 2 FT #SUB 228 243 LYS A 31 31 ARG C Protein A 4 FT #SUB 231 246 ASP A 101 101 TYR C Protein S 3 FT #SUB 233 248 PRO A 101 101 TYR C Protein S 4 FT #SUB 233 248 PRO A 104 104 GLY C Protein S 1 FT #SUB 234 249 LEU A 103 103 TYR C Protein A 3 FT #SUB 235 250 ASN A 103 103 TYR C Protein A 5 FT #SUB 235 250 ASN A 104 104 GLY C Protein S 8 FT #SUB 235 250 ASN A 105 105 TYR C Protein S 3 FT #SUB 366 381 GLN A 106 106 TRP C Protein B 2 FT #SUB 367 382 TYR A 106 106 TRP C Protein B 3 FT #SUB 368 383 HIS A 33 33 TRP C Protein S 8 FT #SUB 368 383 HIS A 50 50 GLU C Protein S 7 FT #SUB 368 383 HIS A 106 106 TRP C Protein S 17 FT #SUB 365 380 PRO A 93 93 HIS D Protein S 6 FT #SUB 366 381 GLN A 90 90 TRP D Protein A 3 FT #SUB 368 383 HIS A 90 90 TRP D Protein S 5 FT #SUB 216 231 ILE A 103 103 TYR E Protein A 4 FT #SUB 219 234 HIS A 102 102 GLY E Protein S 1 FT #SUB 219 234 HIS A 103 103 TYR E Protein S 1 FT #SUB 220 235 GLU A 100 100 TYR E Protein S 5 FT #SUB 220 235 GLU A 101 101 TYR E Protein S 1 FT #SUB 220 235 GLU A 102 102 GLY E Protein S 1 FT #SUB 219 234 HIS A 52 52 LYS F Protein S 4 FT #HET 92 107 SER A 1 501 F A S 2 FT #HET 340 355 GLY A 1 501 F A B 2 FT #HET 341 356 ILE A 1 501 F A A 5 FT #HET 342 357 PHE A 1 501 F A B 1 FT #HET 430 445 TYR A 1 501 F A S 3 FT DISORDER 1 1 FT DISORDER 446 446 CC SEQUENCE 444 AA (ATOM); CC RRRQLIRQLL ERDKTPLAIL FMAAVVGTLV GLAAVAFDKG VAWLQNQRMG ALVHTADNYP CC LLLTVAFLCS AVLAMFGYFL VRKYAPEAGG SGIPEIEGAL EDQRPVRWWR VLPVKFFGGL CC GTLGGGMVLG REGPTVQIGG NIGRMVLDIF RLKGDEARHT LLATGAAAGL AAAFNAPLAG CC ILFIIEEMRP QFRYTLISIK AVFIGVIMST IMYRIFNHEV ALIDVGKLSD APLNTLWLYL CC ILGIIFGIFG PIFNKWVLGM QDLLHRVHGG NITKWVLMGG AIGGLCGLLG FVAPATSGGG CC FNLIPIATAG NFSMGMLVFI FVARVITTLL CFSSGAPGGI FAPMLALGTV LGTAFGMVAV CC ELFPQYHLEA GTFAIAGMGA LLAASIRAPL TGIILVLEMT DNYQLILPMI ITGLGATLLA CC QFTGGKPLYS AILARTLAKQ EAEQ CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MRRRQLIRQLLERDKTPLAILFMAAVVGTLVGLAAVAFDKGVAWLQNQRM CC ATOM -RRRQLIRQLLERDKTPLAILFMAAVVGTLVGLAAVAFDKGVAWLQNQRM CC ************************************************* CC SEQRES GALVHTADNYPLLLTVAFLCSAVLAMFGYFLVRKYAPEAGGSGIPEIEGA CC ATOM GALVHTADNYPLLLTVAFLCSAVLAMFGYFLVRKYAPEAGGSGIPEIEGA CC ************************************************** CC SEQRES LEDQRPVRWWRVLPVKFFGGLGTLGGGMVLGREGPTVQIGGNIGRMVLDI CC ATOM LEDQRPVRWWRVLPVKFFGGLGTLGGGMVLGREGPTVQIGGNIGRMVLDI CC ************************************************** CC SEQRES FRLKGDEARHTLLATGAAAGLAAAFNAPLAGILFIIEEMRPQFRYTLISI CC ATOM FRLKGDEARHTLLATGAAAGLAAAFNAPLAGILFIIEEMRPQFRYTLISI CC ************************************************** CC SEQRES KAVFIGVIMSTIMYRIFNHEVALIDVGKLSDAPLNTLWLYLILGIIFGIF CC ATOM KAVFIGVIMSTIMYRIFNHEVALIDVGKLSDAPLNTLWLYLILGIIFGIF CC ************************************************** CC SEQRES GPIFNKWVLGMQDLLHRVHGGNITKWVLMGGAIGGLCGLLGFVAPATSGG CC ATOM GPIFNKWVLGMQDLLHRVHGGNITKWVLMGGAIGGLCGLLGFVAPATSGG CC ************************************************** CC SEQRES GFNLIPIATAGNFSMGMLVFIFVARVITTLLCFSSGAPGGIFAPMLALGT CC ATOM GFNLIPIATAGNFSMGMLVFIFVARVITTLLCFSSGAPGGIFAPMLALGT CC ************************************************** CC SEQRES VLGTAFGMVAVELFPQYHLEAGTFAIAGMGALLAASIRAPLTGIILVLEM CC ATOM VLGTAFGMVAVELFPQYHLEAGTFAIAGMGALLAASIRAPLTGIILVLEM CC ************************************************** CC SEQRES TDNYQLILPMIITGLGATLLAQFTGGKPLYSAILARTLAKQEAEQK CC ATOM TDNYQLILPMIITGLGATLLAQFTGGKPLYSAILARTLAKQEAEQ- CC ********************************************* SQ SEQUENCE 446 AA; MW; CN; MRRRQLIRQL LERDKTPLAI LFMAAVVGTL VGLAAVAFDK GVAWLQNQRM GALVHTADNY PLLLTVAFLC SAVLAMFGYF LVRKYAPEAG GSGIPEIEGA LEDQRPVRWW RVLPVKFFGG LGTLGGGMVL GREGPTVQIG GNIGRMVLDI FRLKGDEARH TLLATGAAAG LAAAFNAPLA GILFIIEEMR PQFRYTLISI KAVFIGVIMS TIMYRIFNHE VALIDVGKLS DAPLNTLWLY LILGIIFGIF GPIFNKWVLG MQDLLHRVHG GNITKWVLMG GAIGGLCGLL GFVAPATSGG GFNLIPIATA GNFSMGMLVF IFVARVITTL LCFSSGAPGG IFAPMLALGT VLGTAFGMVA VELFPQYHLE AGTFAIAGMG ALLAASIRAP LTGIILVLEM TDNYQLILPM IITGLGATLL AQFTGGKPLY SAILARTLAK QEAEQK // ID 4KJQB STANDARD; PRT; 446 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE H(+)/Cl(-) exchange transporter ClcA OS Escherichia coli CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 3 18 ARG B 104 119 GLN A Protein S 4 FT #SUB 3 18 ARG B 441 456 GLN A Protein S 7 FT #SUB 3 18 ARG B 442 457 GLU A Protein S 5 FT #SUB 4 19 ARG B 442 457 GLU A Protein S 2 FT #SUB 6 21 LEU B 102 117 GLU A Protein S 7 FT #SUB 6 21 LEU B 104 119 GLN A Protein S 1 FT #SUB 6 21 LEU B 438 453 LEU A Protein S 1 FT #SUB 7 22 ILE B 438 453 LEU A Protein S 4 FT #SUB 7 22 ILE B 439 454 ALA A Protein S 2 FT #SUB 9 24 GLN B 193 208 PHE A Protein A 17 FT #SUB 10 25 LEU B 193 208 PHE A Protein A 4 FT #SUB 10 25 LEU B 431 446 SER A Protein S 2 FT #SUB 10 25 LEU B 434 449 LEU A Protein S 1 FT #SUB 10 25 LEU B 435 450 ALA A Protein S 1 FT #SUB 11 26 LEU B 427 442 LYS A Protein A 5 FT #SUB 13 28 ARG B 187 202 GLU A Protein S 1 FT #SUB 13 28 ARG B 188 203 GLU A Protein S 6 FT #SUB 13 28 ARG B 192 207 GLN A Protein S 8 FT #SUB 13 28 ARG B 193 208 PHE A Protein S 2 FT #SUB 13 28 ARG B 428 443 PRO A Protein S 2 FT #SUB 13 28 ARG B 431 446 SER A Protein S 3 FT #SUB 14 29 ASP B 388 403 ARG A Protein A 7 FT #SUB 14 29 ASP B 418 433 THR A Protein S 1 FT #SUB 14 29 ASP B 422 437 GLN A Protein B 3 FT #SUB 15 30 LYS B 422 437 GLN A Protein B 5 FT #SUB 16 31 THR B 422 437 GLN A Protein B 7 FT #SUB 18 33 LEU B 423 438 PHE A Protein S 4 FT #SUB 21 36 LEU B 419 434 LEU A Protein S 1 FT #SUB 21 36 LEU B 423 438 PHE A Protein S 2 FT #SUB 102 117 GLU B 2 17 ARG A Protein A 4 FT #SUB 102 117 GLU B 6 21 LEU A Protein S 6 FT #SUB 104 119 GLN B 2 17 ARG A Protein S 3 FT #SUB 104 119 GLN B 3 18 ARG A Protein S 3 FT #SUB 104 119 GLN B 6 21 LEU A Protein S 1 FT #SUB 176 191 ASN B 404 419 TYR A Protein B 1 FT #SUB 178 193 PRO B 404 419 TYR A Protein S 1 FT #SUB 178 193 PRO B 411 426 ILE A Protein S 2 FT #SUB 179 194 LEU B 407 422 ILE A Protein S 1 FT #SUB 182 197 ILE B 391 406 LEU A Protein S 1 FT #SUB 186 201 ILE B 391 406 LEU A Protein S 1 FT #SUB 187 202 GLU B 13 28 ARG A Protein B 1 FT #SUB 188 203 GLU B 13 28 ARG A Protein A 7 FT #SUB 192 207 GLN B 13 28 ARG A Protein S 8 FT #SUB 192 207 GLN B 195 210 TYR A Protein B 3 FT #SUB 193 208 PHE B 9 24 GLN A Protein S 19 FT #SUB 193 208 PHE B 10 25 LEU A Protein S 3 FT #SUB 193 208 PHE B 13 28 ARG A Protein S 3 FT #SUB 193 208 PHE B 195 210 TYR A Protein B 9 FT #SUB 194 209 ARG B 2 17 ARG A Protein S 2 FT #SUB 194 209 ARG B 195 210 TYR A Protein B 5 FT #SUB 195 210 TYR B 192 207 GLN A Protein S 3 FT #SUB 195 210 TYR B 193 208 PHE A Protein S 9 FT #SUB 195 210 TYR B 194 209 ARG A Protein S 6 FT #SUB 195 210 TYR B 195 210 TYR A Protein A 3 FT #SUB 201 216 LYS B 388 403 ARG A Protein S 1 FT #SUB 201 216 LYS B 418 433 THR A Protein S 5 FT #SUB 201 216 LYS B 419 434 LEU A Protein S 1 FT #SUB 201 216 LYS B 422 437 GLN A Protein S 5 FT #SUB 204 219 PHE B 391 406 LEU A Protein S 4 FT #SUB 204 219 PHE B 411 426 ILE A Protein S 2 FT #SUB 204 219 PHE B 415 430 LEU A Protein S 3 FT #SUB 205 220 ILE B 415 430 LEU A Protein A 4 FT #SUB 205 220 ILE B 419 434 LEU A Protein S 2 FT #SUB 208 223 ILE B 411 426 ILE A Protein S 2 FT #SUB 208 223 ILE B 412 427 ILE A Protein S 1 FT #SUB 208 223 ILE B 415 430 LEU A Protein S 4 FT #SUB 215 230 ARG B 234 249 LEU A Protein A 3 FT #SUB 215 230 ARG B 407 422 ILE A Protein S 1 FT #SUB 215 230 ARG B 408 423 LEU A Protein S 5 FT #SUB 216 231 ILE B 234 249 LEU A Protein B 2 FT #SUB 234 249 LEU B 215 230 ARG A Protein S 3 FT #SUB 234 249 LEU B 216 231 ILE A Protein S 2 FT #SUB 388 403 ARG B 14 29 ASP A Protein S 8 FT #SUB 391 406 LEU B 183 198 LEU A Protein S 1 FT #SUB 391 406 LEU B 186 201 ILE A Protein S 1 FT #SUB 391 406 LEU B 204 219 PHE A Protein S 3 FT #SUB 395 410 ILE B 179 194 LEU A Protein S 1 FT #SUB 395 410 ILE B 395 410 ILE A Protein S 1 FT #SUB 399 414 GLU B 404 419 TYR A Protein A 15 FT #SUB 402 417 ASP B 404 419 TYR A Protein S 2 FT #SUB 404 419 TYR B 399 414 GLU A Protein S 14 FT #SUB 404 419 TYR B 402 417 ASP A Protein S 1 FT #SUB 407 422 ILE B 179 194 LEU A Protein S 2 FT #SUB 408 423 LEU B 211 226 THR A Protein S 1 FT #SUB 408 423 LEU B 215 230 ARG A Protein S 6 FT #SUB 411 426 ILE B 178 193 PRO A Protein S 1 FT #SUB 411 426 ILE B 179 194 LEU A Protein S 1 FT #SUB 411 426 ILE B 204 219 PHE A Protein S 2 FT #SUB 411 426 ILE B 208 223 ILE A Protein S 2 FT #SUB 415 430 LEU B 201 216 LYS A Protein S 1 FT #SUB 415 430 LEU B 204 219 PHE A Protein S 3 FT #SUB 415 430 LEU B 205 220 ILE A Protein S 4 FT #SUB 415 430 LEU B 208 223 ILE A Protein S 3 FT #SUB 418 433 THR B 14 29 ASP A Protein S 1 FT #SUB 418 433 THR B 201 216 LYS A Protein A 5 FT #SUB 419 434 LEU B 21 36 LEU A Protein S 1 FT #SUB 419 434 LEU B 201 216 LYS A Protein S 1 FT #SUB 419 434 LEU B 205 220 ILE A Protein S 2 FT #SUB 422 437 GLN B 14 29 ASP A Protein S 4 FT #SUB 422 437 GLN B 15 30 LYS A Protein S 5 FT #SUB 422 437 GLN B 16 31 THR A Protein S 7 FT #SUB 422 437 GLN B 201 216 LYS A Protein S 5 FT #SUB 423 438 PHE B 18 33 LEU A Protein S 1 FT #SUB 423 438 PHE B 21 36 LEU A Protein S 2 FT #SUB 427 442 LYS B 11 26 LEU A Protein S 8 FT #SUB 428 443 PRO B 13 28 ARG A Protein S 3 FT #SUB 431 446 SER B 10 25 LEU A Protein A 4 FT #SUB 431 446 SER B 13 28 ARG A Protein S 2 FT #SUB 434 449 LEU B 10 25 LEU A Protein S 3 FT #SUB 435 450 ALA B 10 25 LEU A Protein B 1 FT #SUB 438 453 LEU B 3 18 ARG A Protein B 1 FT #SUB 438 453 LEU B 6 21 LEU A Protein S 1 FT #SUB 438 453 LEU B 7 22 ILE A Protein A 4 FT #SUB 439 454 ALA B 7 22 ILE A Protein B 2 FT #SUB 441 456 GLN B 3 18 ARG A Protein S 7 FT #SUB 442 457 GLU B 3 18 ARG A Protein A 8 FT #SUB 442 457 GLU B 4 19 ARG A Protein S 3 FT #SUB 442 457 GLU B 7 22 ILE A Protein S 1 FT #SUB 216 231 ILE B 103 103 TYR C Protein A 4 FT #SUB 219 234 HIS B 102 102 GLY C Protein S 3 FT #SUB 219 234 HIS B 103 103 TYR C Protein S 5 FT #SUB 220 235 GLU B 100 100 TYR C Protein S 3 FT #SUB 220 235 GLU B 101 101 TYR C Protein S 2 FT #SUB 220 235 GLU B 102 102 GLY C Protein S 1 FT #SUB 219 234 HIS B 52 52 LYS D Protein S 2 FT #SUB 228 243 LYS B 31 31 ARG E Protein A 11 FT #SUB 231 246 ASP B 101 101 TYR E Protein S 3 FT #SUB 233 248 PRO B 101 101 TYR E Protein S 4 FT #SUB 233 248 PRO B 104 104 GLY E Protein S 1 FT #SUB 234 249 LEU B 103 103 TYR E Protein A 4 FT #SUB 235 250 ASN B 103 103 TYR E Protein A 5 FT #SUB 235 250 ASN B 104 104 GLY E Protein S 8 FT #SUB 235 250 ASN B 105 105 TYR E Protein S 8 FT #SUB 366 381 GLN B 106 106 TRP E Protein B 1 FT #SUB 367 382 TYR B 106 106 TRP E Protein B 2 FT #SUB 368 383 HIS B 33 33 TRP E Protein A 13 FT #SUB 368 383 HIS B 50 50 GLU E Protein S 7 FT #SUB 368 383 HIS B 106 106 TRP E Protein S 17 FT #SUB 365 380 PRO B 93 93 HIS F Protein S 4 FT #SUB 366 381 GLN B 90 90 TRP F Protein S 1 FT #SUB 368 383 HIS B 90 90 TRP F Protein S 7 FT #HET 92 107 SER B 2 501 F B S 2 FT #HET 340 355 GLY B 2 501 F B B 2 FT #HET 341 356 ILE B 2 501 F B A 5 FT #HET 342 357 PHE B 2 501 F B B 1 FT #HET 430 445 TYR B 2 501 F B S 3 FT DISORDER 1 2 FT DISORDER 444 446 CC SEQUENCE 441 AA (ATOM); CC RRQLIRQLLE RDKTPLAILF MAAVVGTLVG LAAVAFDKGV AWLQNQRMGA LVHTADNYPL CC LLTVAFLCSA VLAMFGYFLV RKYAPEAGGS GIPEIEGALE DQRPVRWWRV LPVKFFGGLG CC TLGGGMVLGR EGPTVQIGGN IGRMVLDIFR LKGDEARHTL LATGAAAGLA AAFNAPLAGI CC LFIIEEMRPQ FRYTLISIKA VFIGVIMSTI MYRIFNHEVA LIDVGKLSDA PLNTLWLYLI CC LGIIFGIFGP IFNKWVLGMQ DLLHRVHGGN ITKWVLMGGA IGGLCGLLGF VAPATSGGGF CC NLIPIATAGN FSMGMLVFIF VARVITTLLC FSSGAPGGIF APMLALGTVL GTAFGMVAVE CC LFPQYHLEAG TFAIAGMGAL LAASIRAPLT GIILVLEMTD NYQLILPMII TGLGATLLAQ CC FTGGKPLYSA ILARTLAKQE A CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MRRRQLIRQLLERDKTPLAILFMAAVVGTLVGLAAVAFDKGVAWLQNQRM CC ATOM --RRQLIRQLLERDKTPLAILFMAAVVGTLVGLAAVAFDKGVAWLQNQRM CC ************************************************ CC SEQRES GALVHTADNYPLLLTVAFLCSAVLAMFGYFLVRKYAPEAGGSGIPEIEGA CC ATOM GALVHTADNYPLLLTVAFLCSAVLAMFGYFLVRKYAPEAGGSGIPEIEGA CC ************************************************** CC SEQRES LEDQRPVRWWRVLPVKFFGGLGTLGGGMVLGREGPTVQIGGNIGRMVLDI CC ATOM LEDQRPVRWWRVLPVKFFGGLGTLGGGMVLGREGPTVQIGGNIGRMVLDI CC ************************************************** CC SEQRES FRLKGDEARHTLLATGAAAGLAAAFNAPLAGILFIIEEMRPQFRYTLISI CC ATOM FRLKGDEARHTLLATGAAAGLAAAFNAPLAGILFIIEEMRPQFRYTLISI CC ************************************************** CC SEQRES KAVFIGVIMSTIMYRIFNHEVALIDVGKLSDAPLNTLWLYLILGIIFGIF CC ATOM KAVFIGVIMSTIMYRIFNHEVALIDVGKLSDAPLNTLWLYLILGIIFGIF CC ************************************************** CC SEQRES GPIFNKWVLGMQDLLHRVHGGNITKWVLMGGAIGGLCGLLGFVAPATSGG CC ATOM GPIFNKWVLGMQDLLHRVHGGNITKWVLMGGAIGGLCGLLGFVAPATSGG CC ************************************************** CC SEQRES GFNLIPIATAGNFSMGMLVFIFVARVITTLLCFSSGAPGGIFAPMLALGT CC ATOM GFNLIPIATAGNFSMGMLVFIFVARVITTLLCFSSGAPGGIFAPMLALGT CC ************************************************** CC SEQRES VLGTAFGMVAVELFPQYHLEAGTFAIAGMGALLAASIRAPLTGIILVLEM CC ATOM VLGTAFGMVAVELFPQYHLEAGTFAIAGMGALLAASIRAPLTGIILVLEM CC ************************************************** CC SEQRES TDNYQLILPMIITGLGATLLAQFTGGKPLYSAILARTLAKQEAEQK CC ATOM TDNYQLILPMIITGLGATLLAQFTGGKPLYSAILARTLAKQEA--- CC ******************************************* SQ SEQUENCE 446 AA; MW; CN; MRRRQLIRQL LERDKTPLAI LFMAAVVGTL VGLAAVAFDK GVAWLQNQRM GALVHTADNY PLLLTVAFLC SAVLAMFGYF LVRKYAPEAG GSGIPEIEGA LEDQRPVRWW RVLPVKFFGG LGTLGGGMVL GREGPTVQIG GNIGRMVLDI FRLKGDEARH TLLATGAAAG LAAAFNAPLA GILFIIEEMR PQFRYTLISI KAVFIGVIMS TIMYRIFNHE VALIDVGKLS DAPLNTLWLY LILGIIFGIF GPIFNKWVLG MQDLLHRVHG GNITKWVLMG GAIGGLCGLL GFVAPATSGG GFNLIPIATA GNFSMGMLVF IFVARVITTL LCFSSGAPGG IFAPMLALGT VLGTAFGMVA VELFPQYHLE AGTFAIAGMG ALLAASIRAP LTGIILVLEM TDNYQLILPM IITGLGATLL AQFTGGKPLY SAILARTLAK QEAEQK // ID 4KJQC STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE Fab, heavy chain OS Mus musculus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 31 31 ARG C 228 243 LYS A Protein S 4 FT #SUB 33 33 TRP C 368 383 HIS A Protein S 8 FT #SUB 50 50 GLU C 368 383 HIS A Protein S 7 FT #SUB 101 101 TYR C 231 246 ASP A Protein S 3 FT #SUB 101 101 TYR C 233 248 PRO A Protein S 4 FT #SUB 103 103 TYR C 234 249 LEU A Protein A 3 FT #SUB 103 103 TYR C 235 250 ASN A Protein B 5 FT #SUB 104 104 GLY C 233 248 PRO A Protein B 1 FT #SUB 104 104 GLY C 235 250 ASN A Protein B 8 FT #SUB 105 105 TYR C 235 250 ASN A Protein S 3 FT #SUB 106 106 TRP C 366 381 GLN A Protein S 2 FT #SUB 106 106 TRP C 367 382 TYR A Protein S 3 FT #SUB 106 106 TRP C 368 383 HIS A Protein S 17 FT #SUB 100 100 TYR C 220 235 GLU B Protein S 3 FT #SUB 101 101 TYR C 220 235 GLU B Protein A 2 FT #SUB 102 102 GLY C 219 234 HIS B Protein B 3 FT #SUB 102 102 GLY C 220 235 GLU B Protein B 1 FT #SUB 103 103 TYR C 216 231 ILE B Protein S 4 FT #SUB 103 103 TYR C 219 234 HIS B Protein S 5 FT #SUB 39 39 GLN C 37 37 GLN D Protein S 3 FT #SUB 39 39 GLN C 86 86 TYR D Protein S 2 FT #SUB 45 45 LEU C 86 86 TYR D Protein S 2 FT #SUB 45 45 LEU C 97 97 PHE D Protein A 10 FT #SUB 47 47 TRP C 94 94 PRO D Protein S 2 FT #SUB 47 47 TRP C 95 95 GLN D Protein S 18 FT #SUB 50 50 GLU C 90 90 TRP D Protein S 5 FT #SUB 95 95 TYR C 37 37 GLN D Protein S 2 FT #SUB 95 95 TYR C 41 41 THR D Protein S 1 FT #SUB 95 95 TYR C 43 43 PRO D Protein S 3 FT #SUB 99 99 LEU C 90 90 TRP D Protein S 2 FT #SUB 102 102 GLY C 49 49 ASP D Protein B 1 FT #SUB 103 103 TYR C 31 31 TYR D Protein S 3 FT #SUB 103 103 TYR C 49 49 ASP D Protein A 4 FT #SUB 103 103 TYR C 52 52 LYS D Protein S 11 FT #SUB 105 105 TYR C 31 31 TYR D Protein S 5 FT #SUB 105 105 TYR C 33 33 HIS D Protein B 3 FT #SUB 105 105 TYR C 91 91 SER D Protein S 2 FT #SUB 106 106 TRP C 33 33 HIS D Protein B 3 FT #SUB 106 106 TRP C 88 88 GLN D Protein B 1 FT #SUB 106 106 TRP C 90 90 TRP D Protein A 6 FT #SUB 107 107 TYR C 33 33 HIS D Protein A 9 FT #SUB 107 107 TYR C 35 35 TYR D Protein A 3 FT #SUB 107 107 TYR C 45 45 ARG D Protein S 14 FT #SUB 107 107 TYR C 48 48 TYR D Protein S 2 FT #SUB 107 107 TYR C 88 88 GLN D Protein A 2 FT #SUB 108 108 PHE C 35 35 TYR D Protein A 9 FT #SUB 108 108 PHE C 45 45 ARG D Protein B 1 FT #SUB 108 108 PHE C 88 88 GLN D Protein S 6 FT #SUB 108 108 PHE C 90 90 TRP D Protein S 1 FT #SUB 108 108 PHE C 95 95 GLN D Protein S 3 FT #SUB 108 108 PHE C 97 97 PHE D Protein S 2 FT #SUB 109 109 ASP C 45 45 ARG D Protein A 6 FT #SUB 111 111 TRP C 35 35 TYR D Protein S 2 FT #SUB 111 111 TRP C 43 43 PRO D Protein S 8 FT #SUB 111 111 TRP C 97 97 PHE D Protein S 2 FT #SUB 112 112 GLY C 42 42 SER D Protein B 3 FT #SUB 113 113 ALA C 42 42 SER D Protein B 2 FT #SUB 130 130 TYR C 120 120 SER D Protein S 3 FT #SUB 130 130 TYR C 123 123 GLN D Protein S 17 FT #SUB 131 131 PRO C 120 120 SER D Protein B 1 FT #SUB 131 131 PRO C 122 122 GLU D Protein S 3 FT #SUB 132 132 LEU C 117 117 PHE D Protein A 5 FT #SUB 132 132 LEU C 132 132 VAL D Protein S 3 FT #SUB 133 133 ALA C 117 117 PHE D Protein B 4 FT #SUB 133 133 ALA C 118 118 PRO D Protein B 1 FT #SUB 145 145 THR C 115 115 SER D Protein S 2 FT #SUB 145 145 THR C 117 117 PHE D Protein A 3 FT #SUB 145 145 THR C 134 134 PHE D Protein S 1 FT #SUB 146 146 LEU C 134 134 PHE D Protein B 1 FT #SUB 149 149 LEU C 130 130 SER D Protein S 2 FT #SUB 149 149 LEU C 132 132 VAL D Protein S 1 FT #SUB 151 151 LYS C 130 130 SER D Protein S 1 FT #SUB 151 151 LYS C 179 179 THR D Protein S 1 FT #SUB 172 172 HIS C 136 136 ASN D Protein S 3 FT #SUB 172 172 HIS C 137 137 ASN D Protein S 4 FT #SUB 172 172 HIS C 166 166 ASP D Protein S 1 FT #SUB 172 172 HIS C 173 173 SER D Protein S 5 FT #SUB 173 173 THR C 163 163 THR D Protein B 1 FT #SUB 174 174 PHE C 134 134 PHE D Protein S 3 FT #SUB 174 174 PHE C 136 136 ASN D Protein S 1 FT #SUB 174 174 PHE C 161 161 SER D Protein A 3 FT #SUB 174 174 PHE C 163 163 THR D Protein S 2 FT #SUB 174 174 PHE C 173 173 SER D Protein S 3 FT #SUB 174 174 PHE C 174 174 MET D Protein S 7 FT #SUB 174 174 PHE C 175 175 SER D Protein S 9 FT #SUB 175 175 PRO C 161 161 SER D Protein A 8 FT #SUB 175 175 PRO C 162 162 TRP D Protein S 2 FT #SUB 175 175 PRO C 163 163 THR D Protein S 1 FT #SUB 177 177 VAL C 159 159 LEU D Protein S 1 FT #SUB 177 177 VAL C 160 160 ASN D Protein S 1 FT #SUB 179 179 GLN C 159 159 LEU D Protein S 3 FT #SUB 186 186 SER C 134 134 PHE D Protein S 1 FT #SUB 186 186 SER C 175 175 SER D Protein S 2 FT #SUB 188 188 SER C 134 134 PHE D Protein A 7 FT #SUB 188 188 SER C 136 136 ASN D Protein S 3 FT #SUB 216 216 LYS C 122 122 GLU D Protein S 1 FT #SUB 221 221 ARG C 118 118 PRO D Protein S 11 FT #SUB 221 221 ARG C 119 119 PRO D Protein S 3 FT DISORDER 1 1 CC SEQUENCE 221 AA (ATOM); CC VRLLESGGGL VQPGGSLKLS CAASGFDYSR YWMSWVRQAP GKGLKWIGEI NPVSSTINYT CC PSLKDKFIIS RDNAKDTLYL QISKVRSEDT ALYYCARLYY GYGYWYFDVW GAGTTVTVSS CC AKTTPPSVYP LAPGSAAAAA SMVTLGCLVK GYFPEPVTVT WNSGSLAAGV HTFPAVLQAA CC LYTLSSSVTV PSSSWPSETV TCNVAHPASS TKVDKKIVPR A CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES EVRLLESGGGLVQPGGSLKLSCAASGFDYSRYWMSWVRQAPGKGLKWIGE CC ATOM -VRLLESGGGLVQPGGSLKLSCAASGFDYSRYWMSWVRQAPGKGLKWIGE CC ************************************************* CC SEQRES INPVSSTINYTPSLKDKFIISRDNAKDTLYLQISKVRSEDTALYYCARLY CC ATOM INPVSSTINYTPSLKDKFIISRDNAKDTLYLQISKVRSEDTALYYCARLY CC ************************************************** CC SEQRES YGYGYWYFDVWGAGTTVTVSSAKTTPPSVYPLAPGSAAAAASMVTLGCLV CC ATOM YGYGYWYFDVWGAGTTVTVSSAKTTPPSVYPLAPGSAAAAASMVTLGCLV CC ************************************************** CC SEQRES KGYFPEPVTVTWNSGSLAAGVHTFPAVLQAALYTLSSSVTVPSSSWPSET CC ATOM KGYFPEPVTVTWNSGSLAAGVHTFPAVLQAALYTLSSSVTVPSSSWPSET CC ************************************************** CC SEQRES VTCNVAHPASSTKVDKKIVPRA CC ATOM VTCNVAHPASSTKVDKKIVPRA CC ********************** SQ SEQUENCE 222 AA; MW; CN; EVRLLESGGG LVQPGGSLKL SCAASGFDYS RYWMSWVRQA PGKGLKWIGE INPVSSTINY TPSLKDKFII SRDNAKDTLY LQISKVRSED TALYYCARLY YGYGYWYFDV WGAGTTVTVS SAKTTPPSVY PLAPGSAAAA ASMVTLGCLV KGYFPEPVTV TWNSGSLAAG VHTFPAVLQA ALYTLSSSVT VPSSSWPSET VTCNVAHPAS STKVDKKIVP RA // ID 4KJQD STANDARD; PRT; 211 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE Fab, light chain OS Mus musculus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 90 90 TRP D 366 381 GLN A Protein A 3 FT #SUB 90 90 TRP D 368 383 HIS A Protein S 5 FT #SUB 93 93 HIS D 365 380 PRO A Protein S 6 FT #SUB 52 52 LYS D 219 234 HIS B Protein S 2 FT #SUB 31 31 TYR D 103 103 TYR C Protein S 3 FT #SUB 31 31 TYR D 105 105 TYR C Protein S 5 FT #SUB 33 33 HIS D 105 105 TYR C Protein S 3 FT #SUB 33 33 HIS D 106 106 TRP C Protein S 3 FT #SUB 33 33 HIS D 107 107 TYR C Protein S 9 FT #SUB 35 35 TYR D 107 107 TYR C Protein S 3 FT #SUB 35 35 TYR D 108 108 PHE C Protein S 9 FT #SUB 35 35 TYR D 111 111 TRP C Protein S 2 FT #SUB 37 37 GLN D 39 39 GLN C Protein S 3 FT #SUB 37 37 GLN D 95 95 TYR C Protein S 2 FT #SUB 41 41 THR D 95 95 TYR C Protein B 1 FT #SUB 42 42 SER D 112 112 GLY C Protein S 3 FT #SUB 42 42 SER D 113 113 ALA C Protein S 2 FT #SUB 43 43 PRO D 95 95 TYR C Protein S 3 FT #SUB 43 43 PRO D 111 111 TRP C Protein A 8 FT #SUB 45 45 ARG D 107 107 TYR C Protein S 14 FT #SUB 45 45 ARG D 108 108 PHE C Protein S 1 FT #SUB 45 45 ARG D 109 109 ASP C Protein S 6 FT #SUB 48 48 TYR D 107 107 TYR C Protein S 2 FT #SUB 49 49 ASP D 102 102 GLY C Protein S 1 FT #SUB 49 49 ASP D 103 103 TYR C Protein S 4 FT #SUB 52 52 LYS D 103 103 TYR C Protein S 11 FT #SUB 86 86 TYR D 39 39 GLN C Protein S 2 FT #SUB 86 86 TYR D 45 45 LEU C Protein S 2 FT #SUB 88 88 GLN D 106 106 TRP C Protein S 1 FT #SUB 88 88 GLN D 107 107 TYR C Protein S 2 FT #SUB 88 88 GLN D 108 108 PHE C Protein S 6 FT #SUB 90 90 TRP D 50 50 GLU C Protein S 5 FT #SUB 90 90 TRP D 99 99 LEU C Protein S 2 FT #SUB 90 90 TRP D 106 106 TRP C Protein S 6 FT #SUB 90 90 TRP D 108 108 PHE C Protein S 1 FT #SUB 91 91 SER D 105 105 TYR C Protein B 2 FT #SUB 94 94 PRO D 47 47 TRP C Protein S 2 FT #SUB 95 95 GLN D 47 47 TRP C Protein S 18 FT #SUB 95 95 GLN D 108 108 PHE C Protein S 3 FT #SUB 97 97 PHE D 45 45 LEU C Protein S 10 FT #SUB 97 97 PHE D 108 108 PHE C Protein S 2 FT #SUB 97 97 PHE D 111 111 TRP C Protein S 2 FT #SUB 115 115 SER D 145 145 THR C Protein S 2 FT #SUB 117 117 PHE D 132 132 LEU C Protein S 5 FT #SUB 117 117 PHE D 133 133 ALA C Protein S 4 FT #SUB 117 117 PHE D 145 145 THR C Protein S 3 FT #SUB 118 118 PRO D 133 133 ALA C Protein S 1 FT #SUB 118 118 PRO D 221 221 ARG C Protein A 11 FT #SUB 119 119 PRO D 221 221 ARG C Protein B 3 FT #SUB 120 120 SER D 130 130 TYR C Protein S 3 FT #SUB 120 120 SER D 131 131 PRO C Protein S 1 FT #SUB 122 122 GLU D 131 131 PRO C Protein S 3 FT #SUB 122 122 GLU D 216 216 LYS C Protein S 1 FT #SUB 123 123 GLN D 130 130 TYR C Protein A 17 FT #SUB 130 130 SER D 149 149 LEU C Protein S 2 FT #SUB 130 130 SER D 151 151 LYS C Protein S 1 FT #SUB 132 132 VAL D 132 132 LEU C Protein S 3 FT #SUB 132 132 VAL D 149 149 LEU C Protein S 1 FT #SUB 134 134 PHE D 145 145 THR C Protein S 1 FT #SUB 134 134 PHE D 146 146 LEU C Protein S 1 FT #SUB 134 134 PHE D 174 174 PHE C Protein S 3 FT #SUB 134 134 PHE D 186 186 SER C Protein S 1 FT #SUB 134 134 PHE D 188 188 SER C Protein S 7 FT #SUB 136 136 ASN D 172 172 HIS C Protein S 3 FT #SUB 136 136 ASN D 174 174 PHE C Protein S 1 FT #SUB 136 136 ASN D 188 188 SER C Protein S 3 FT #SUB 137 137 ASN D 172 172 HIS C Protein S 4 FT #SUB 159 159 LEU D 177 177 VAL C Protein S 1 FT #SUB 159 159 LEU D 179 179 GLN C Protein S 3 FT #SUB 160 160 ASN D 177 177 VAL C Protein B 1 FT #SUB 161 161 SER D 174 174 PHE C Protein A 3 FT #SUB 161 161 SER D 175 175 PRO C Protein S 8 FT #SUB 162 162 TRP D 175 175 PRO C Protein B 2 FT #SUB 163 163 THR D 173 173 THR C Protein S 1 FT #SUB 163 163 THR D 174 174 PHE C Protein S 2 FT #SUB 163 163 THR D 175 175 PRO C Protein B 1 FT #SUB 166 166 ASP D 172 172 HIS C Protein S 1 FT #SUB 173 173 SER D 172 172 HIS C Protein S 5 FT #SUB 173 173 SER D 174 174 PHE C Protein A 3 FT #SUB 174 174 MET D 174 174 PHE C Protein B 7 FT #SUB 175 175 SER D 174 174 PHE C Protein A 9 FT #SUB 175 175 SER D 186 186 SER C Protein S 2 FT #SUB 179 179 THR D 151 151 LYS C Protein S 1 CC SEQUENCE 211 AA (ATOM); CC DIVLTQSPAI MSAAPGDKVT MTCSASSSVS YIHWYQQKSG TSPKRWIYDT SKLTSGVPVR CC FSGSGSGTSY SLTINTMEAE DAATYYCQQW SSHPQTFGGG TKLEILRADA APTVSIFPPS CC SEQLTSGGAS VVCFLNNFYP KDINVKWKID GSERQNGVLN SWTDQDSKDS TYSMSSTLTL CC TKDEYERHNS YTCEATHKTS TSPIVKSFNR A CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES DIVLTQSPAIMSAAPGDKVTMTCSASSSVSYIHWYQQKSGTSPKRWIYDT CC ATOM DIVLTQSPAIMSAAPGDKVTMTCSASSSVSYIHWYQQKSGTSPKRWIYDT CC ************************************************** CC SEQRES SKLTSGVPVRFSGSGSGTSYSLTINTMEAEDAATYYCQQWSSHPQTFGGG CC ATOM SKLTSGVPVRFSGSGSGTSYSLTINTMEAEDAATYYCQQWSSHPQTFGGG CC ************************************************** CC SEQRES TKLEILRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKID CC ATOM TKLEILRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKID CC ************************************************** CC SEQRES GSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTS CC ATOM GSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTS CC ************************************************** CC SEQRES TSPIVKSFNRA CC ATOM TSPIVKSFNRA CC *********** SQ SEQUENCE 211 AA; MW; CN; DIVLTQSPAI MSAAPGDKVT MTCSASSSVS YIHWYQQKSG TSPKRWIYDT SKLTSGVPVR FSGSGSGTSY SLTINTMEAE DAATYYCQQW SSHPQTFGGG TKLEILRADA APTVSIFPPS SEQLTSGGAS VVCFLNNFYP KDINVKWKID GSERQNGVLN SWTDQDSKDS TYSMSSTLTL TKDEYERHNS YTCEATHKTS TSPIVKSFNR A // ID 4KJQE STANDARD; PRT; 222 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE Fab, heavy chain OS Mus musculus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 100 100 TYR E 220 235 GLU A Protein S 5 FT #SUB 101 101 TYR E 220 235 GLU A Protein B 1 FT #SUB 102 102 GLY E 219 234 HIS A Protein B 1 FT #SUB 102 102 GLY E 220 235 GLU A Protein B 1 FT #SUB 103 103 TYR E 216 231 ILE A Protein S 4 FT #SUB 103 103 TYR E 219 234 HIS A Protein S 1 FT #SUB 31 31 ARG E 228 243 LYS B Protein S 11 FT #SUB 33 33 TRP E 368 383 HIS B Protein S 13 FT #SUB 50 50 GLU E 368 383 HIS B Protein S 7 FT #SUB 101 101 TYR E 231 246 ASP B Protein S 3 FT #SUB 101 101 TYR E 233 248 PRO B Protein S 4 FT #SUB 103 103 TYR E 234 249 LEU B Protein B 4 FT #SUB 103 103 TYR E 235 250 ASN B Protein B 5 FT #SUB 104 104 GLY E 233 248 PRO B Protein B 1 FT #SUB 104 104 GLY E 235 250 ASN B Protein B 8 FT #SUB 105 105 TYR E 235 250 ASN B Protein A 8 FT #SUB 106 106 TRP E 366 381 GLN B Protein S 1 FT #SUB 106 106 TRP E 367 382 TYR B Protein S 2 FT #SUB 106 106 TRP E 368 383 HIS B Protein S 17 FT #SUB 39 39 GLN E 37 37 GLN F Protein S 7 FT #SUB 39 39 GLN E 86 86 TYR F Protein S 1 FT #SUB 43 43 LYS E 86 86 TYR F Protein B 1 FT #SUB 44 44 GLY E 86 86 TYR F Protein B 1 FT #SUB 45 45 LEU E 86 86 TYR F Protein S 3 FT #SUB 45 45 LEU E 97 97 PHE F Protein A 6 FT #SUB 47 47 TRP E 93 93 HIS F Protein S 2 FT #SUB 47 47 TRP E 94 94 PRO F Protein S 2 FT #SUB 47 47 TRP E 95 95 GLN F Protein S 18 FT #SUB 50 50 GLU E 90 90 TRP F Protein S 5 FT #SUB 50 50 GLU E 93 93 HIS F Protein S 1 FT #SUB 62 62 PRO E 1 1 ASP F Protein S 1 FT #SUB 95 95 TYR E 37 37 GLN F Protein S 1 FT #SUB 95 95 TYR E 42 42 SER F Protein S 3 FT #SUB 95 95 TYR E 43 43 PRO F Protein S 3 FT #SUB 99 99 LEU E 90 90 TRP F Protein S 2 FT #SUB 102 102 GLY E 49 49 ASP F Protein B 2 FT #SUB 103 103 TYR E 31 31 TYR F Protein S 3 FT #SUB 103 103 TYR E 49 49 ASP F Protein A 6 FT #SUB 103 103 TYR E 52 52 LYS F Protein A 12 FT #SUB 105 105 TYR E 30 30 SER F Protein S 1 FT #SUB 105 105 TYR E 31 31 TYR F Protein S 5 FT #SUB 105 105 TYR E 33 33 HIS F Protein B 3 FT #SUB 105 105 TYR E 90 90 TRP F Protein S 1 FT #SUB 105 105 TYR E 91 91 SER F Protein S 4 FT #SUB 106 106 TRP E 33 33 HIS F Protein B 3 FT #SUB 106 106 TRP E 88 88 GLN F Protein B 1 FT #SUB 106 106 TRP E 90 90 TRP F Protein A 6 FT #SUB 107 107 TYR E 33 33 HIS F Protein S 3 FT #SUB 107 107 TYR E 35 35 TYR F Protein A 3 FT #SUB 107 107 TYR E 45 45 ARG F Protein S 15 FT #SUB 107 107 TYR E 48 48 TYR F Protein S 1 FT #SUB 108 108 PHE E 35 35 TYR F Protein A 11 FT #SUB 108 108 PHE E 45 45 ARG F Protein B 2 FT #SUB 108 108 PHE E 88 88 GLN F Protein S 4 FT #SUB 108 108 PHE E 90 90 TRP F Protein S 1 FT #SUB 108 108 PHE E 95 95 GLN F Protein S 2 FT #SUB 108 108 PHE E 97 97 PHE F Protein S 2 FT #SUB 109 109 ASP E 45 45 ARG F Protein A 6 FT #SUB 111 111 TRP E 35 35 TYR F Protein S 2 FT #SUB 111 111 TRP E 43 43 PRO F Protein S 7 FT #SUB 112 112 GLY E 42 42 SER F Protein B 3 FT #SUB 113 113 ALA E 42 42 SER F Protein B 4 FT #SUB 130 130 TYR E 120 120 SER F Protein S 3 FT #SUB 130 130 TYR E 123 123 GLN F Protein S 15 FT #SUB 131 131 PRO E 120 120 SER F Protein B 1 FT #SUB 131 131 PRO E 122 122 GLU F Protein S 3 FT #SUB 132 132 LEU E 117 117 PHE F Protein S 1 FT #SUB 132 132 LEU E 132 132 VAL F Protein S 2 FT #SUB 133 133 ALA E 117 117 PHE F Protein B 2 FT #SUB 133 133 ALA E 118 118 PRO F Protein B 1 FT #SUB 134 134 PRO E 117 117 PHE F Protein B 1 FT #SUB 145 145 THR E 115 115 SER F Protein S 3 FT #SUB 145 145 THR E 117 117 PHE F Protein A 4 FT #SUB 149 149 LEU E 130 130 SER F Protein S 2 FT #SUB 149 149 LEU E 132 132 VAL F Protein S 1 FT #SUB 151 151 LYS E 130 130 SER F Protein S 1 FT #SUB 151 151 LYS E 179 179 THR F Protein S 1 FT #SUB 172 172 HIS E 136 136 ASN F Protein S 2 FT #SUB 172 172 HIS E 137 137 ASN F Protein S 4 FT #SUB 172 172 HIS E 173 173 SER F Protein S 4 FT #SUB 174 174 PHE E 134 134 PHE F Protein S 2 FT #SUB 174 174 PHE E 136 136 ASN F Protein S 1 FT #SUB 174 174 PHE E 161 161 SER F Protein A 2 FT #SUB 174 174 PHE E 163 163 THR F Protein S 2 FT #SUB 174 174 PHE E 173 173 SER F Protein S 4 FT #SUB 174 174 PHE E 174 174 MET F Protein S 6 FT #SUB 174 174 PHE E 175 175 SER F Protein S 6 FT #SUB 175 175 PRO E 161 161 SER F Protein A 8 FT #SUB 175 175 PRO E 162 162 TRP F Protein S 2 FT #SUB 177 177 VAL E 159 159 LEU F Protein S 1 FT #SUB 177 177 VAL E 160 160 ASN F Protein S 1 FT #SUB 186 186 SER E 134 134 PHE F Protein S 1 FT #SUB 186 186 SER E 175 175 SER F Protein S 1 FT #SUB 187 187 SER E 134 134 PHE F Protein B 2 FT #SUB 188 188 SER E 134 134 PHE F Protein A 7 FT #SUB 188 188 SER E 136 136 ASN F Protein S 3 FT #SUB 216 216 LYS E 122 122 GLU F Protein S 2 FT #SUB 221 221 ARG E 118 118 PRO F Protein S 8 FT #SUB 221 221 ARG E 119 119 PRO F Protein S 4 FT DISORDER 1 1 CC SEQUENCE 221 AA (ATOM); CC VRLLESGGGL VQPGGSLKLS CAASGFDYSR YWMSWVRQAP GKGLKWIGEI NPVSSTINYT CC PSLKDKFIIS RDNAKDTLYL QISKVRSEDT ALYYCARLYY GYGYWYFDVW GAGTTVTVSS CC AKTTPPSVYP LAPGSAAAAA SMVTLGCLVK GYFPEPVTVT WNSGSLAAGV HTFPAVLQAA CC LYTLSSSVTV PSSSWPSETV TCNVAHPASS TKVDKKIVPR A CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES EVRLLESGGGLVQPGGSLKLSCAASGFDYSRYWMSWVRQAPGKGLKWIGE CC ATOM -VRLLESGGGLVQPGGSLKLSCAASGFDYSRYWMSWVRQAPGKGLKWIGE CC ************************************************* CC SEQRES INPVSSTINYTPSLKDKFIISRDNAKDTLYLQISKVRSEDTALYYCARLY CC ATOM INPVSSTINYTPSLKDKFIISRDNAKDTLYLQISKVRSEDTALYYCARLY CC ************************************************** CC SEQRES YGYGYWYFDVWGAGTTVTVSSAKTTPPSVYPLAPGSAAAAASMVTLGCLV CC ATOM YGYGYWYFDVWGAGTTVTVSSAKTTPPSVYPLAPGSAAAAASMVTLGCLV CC ************************************************** CC SEQRES KGYFPEPVTVTWNSGSLAAGVHTFPAVLQAALYTLSSSVTVPSSSWPSET CC ATOM KGYFPEPVTVTWNSGSLAAGVHTFPAVLQAALYTLSSSVTVPSSSWPSET CC ************************************************** CC SEQRES VTCNVAHPASSTKVDKKIVPRA CC ATOM VTCNVAHPASSTKVDKKIVPRA CC ********************** SQ SEQUENCE 222 AA; MW; CN; EVRLLESGGG LVQPGGSLKL SCAASGFDYS RYWMSWVRQA PGKGLKWIGE INPVSSTINY TPSLKDKFII SRDNAKDTLY LQISKVRSED TALYYCARLY YGYGYWYFDV WGAGTTVTVS SAKTTPPSVY PLAPGSAAAA ASMVTLGCLV KGYFPEPVTV TWNSGSLAAG VHTFPAVLQA ALYTLSSSVT VPSSSWPSET VTCNVAHPAS STKVDKKIVP RA // ID 4KJQF STANDARD; PRT; 211 AA. DT CONVERTED FROM PDB (SEQRES) 4KJQ DE Fab, light chain OS Mus musculus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.880 CC R-Factor 0.222 FT #SUB 52 52 LYS F 219 234 HIS A Protein S 4 FT #SUB 90 90 TRP F 366 381 GLN B Protein B 1 FT #SUB 90 90 TRP F 368 383 HIS B Protein S 7 FT #SUB 93 93 HIS F 365 380 PRO B Protein S 4 FT #SUB 1 1 ASP F 62 62 PRO E Protein S 1 FT #SUB 30 30 SER F 105 105 TYR E Protein S 1 FT #SUB 31 31 TYR F 103 103 TYR E Protein S 3 FT #SUB 31 31 TYR F 105 105 TYR E Protein S 5 FT #SUB 33 33 HIS F 105 105 TYR E Protein S 3 FT #SUB 33 33 HIS F 106 106 TRP E Protein S 3 FT #SUB 33 33 HIS F 107 107 TYR E Protein S 3 FT #SUB 35 35 TYR F 107 107 TYR E Protein S 3 FT #SUB 35 35 TYR F 108 108 PHE E Protein S 11 FT #SUB 35 35 TYR F 111 111 TRP E Protein S 2 FT #SUB 37 37 GLN F 39 39 GLN E Protein S 7 FT #SUB 37 37 GLN F 95 95 TYR E Protein S 1 FT #SUB 42 42 SER F 95 95 TYR E Protein S 3 FT #SUB 42 42 SER F 112 112 GLY E Protein S 3 FT #SUB 42 42 SER F 113 113 ALA E Protein S 4 FT #SUB 43 43 PRO F 95 95 TYR E Protein S 3 FT #SUB 43 43 PRO F 111 111 TRP E Protein A 7 FT #SUB 45 45 ARG F 107 107 TYR E Protein S 15 FT #SUB 45 45 ARG F 108 108 PHE E Protein S 2 FT #SUB 45 45 ARG F 109 109 ASP E Protein S 6 FT #SUB 48 48 TYR F 107 107 TYR E Protein S 1 FT #SUB 49 49 ASP F 102 102 GLY E Protein S 2 FT #SUB 49 49 ASP F 103 103 TYR E Protein S 6 FT #SUB 52 52 LYS F 103 103 TYR E Protein S 12 FT #SUB 86 86 TYR F 39 39 GLN E Protein S 1 FT #SUB 86 86 TYR F 43 43 LYS E Protein S 1 FT #SUB 86 86 TYR F 44 44 GLY E Protein S 1 FT #SUB 86 86 TYR F 45 45 LEU E Protein S 3 FT #SUB 88 88 GLN F 106 106 TRP E Protein S 1 FT #SUB 88 88 GLN F 108 108 PHE E Protein S 4 FT #SUB 90 90 TRP F 50 50 GLU E Protein S 5 FT #SUB 90 90 TRP F 99 99 LEU E Protein S 2 FT #SUB 90 90 TRP F 105 105 TYR E Protein B 1 FT #SUB 90 90 TRP F 106 106 TRP E Protein S 6 FT #SUB 90 90 TRP F 108 108 PHE E Protein S 1 FT #SUB 91 91 SER F 105 105 TYR E Protein A 4 FT #SUB 93 93 HIS F 47 47 TRP E Protein S 2 FT #SUB 93 93 HIS F 50 50 GLU E Protein S 1 FT #SUB 94 94 PRO F 47 47 TRP E Protein S 2 FT #SUB 95 95 GLN F 47 47 TRP E Protein S 18 FT #SUB 95 95 GLN F 108 108 PHE E Protein S 2 FT #SUB 97 97 PHE F 45 45 LEU E Protein S 6 FT #SUB 97 97 PHE F 108 108 PHE E Protein S 2 FT #SUB 115 115 SER F 145 145 THR E Protein S 3 FT #SUB 117 117 PHE F 132 132 LEU E Protein S 1 FT #SUB 117 117 PHE F 133 133 ALA E Protein S 2 FT #SUB 117 117 PHE F 134 134 PRO E Protein S 1 FT #SUB 117 117 PHE F 145 145 THR E Protein S 4 FT #SUB 118 118 PRO F 133 133 ALA E Protein S 1 FT #SUB 118 118 PRO F 221 221 ARG E Protein A 8 FT #SUB 119 119 PRO F 221 221 ARG E Protein B 4 FT #SUB 120 120 SER F 130 130 TYR E Protein S 3 FT #SUB 120 120 SER F 131 131 PRO E Protein S 1 FT #SUB 122 122 GLU F 131 131 PRO E Protein S 3 FT #SUB 122 122 GLU F 216 216 LYS E Protein S 2 FT #SUB 123 123 GLN F 130 130 TYR E Protein A 15 FT #SUB 130 130 SER F 149 149 LEU E Protein S 2 FT #SUB 130 130 SER F 151 151 LYS E Protein S 1 FT #SUB 132 132 VAL F 132 132 LEU E Protein S 2 FT #SUB 132 132 VAL F 149 149 LEU E Protein S 1 FT #SUB 134 134 PHE F 174 174 PHE E Protein S 2 FT #SUB 134 134 PHE F 186 186 SER E Protein S 1 FT #SUB 134 134 PHE F 187 187 SER E Protein S 2 FT #SUB 134 134 PHE F 188 188 SER E Protein S 7 FT #SUB 136 136 ASN F 172 172 HIS E Protein S 2 FT #SUB 136 136 ASN F 174 174 PHE E Protein S 1 FT #SUB 136 136 ASN F 188 188 SER E Protein S 3 FT #SUB 137 137 ASN F 172 172 HIS E Protein S 4 FT #SUB 159 159 LEU F 177 177 VAL E Protein S 1 FT #SUB 160 160 ASN F 177 177 VAL E Protein B 1 FT #SUB 161 161 SER F 174 174 PHE E Protein A 2 FT #SUB 161 161 SER F 175 175 PRO E Protein S 8 FT #SUB 162 162 TRP F 175 175 PRO E Protein B 2 FT #SUB 163 163 THR F 174 174 PHE E Protein S 2 FT #SUB 173 173 SER F 172 172 HIS E Protein S 4 FT #SUB 173 173 SER F 174 174 PHE E Protein A 4 FT #SUB 174 174 MET F 174 174 PHE E Protein B 6 FT #SUB 175 175 SER F 174 174 PHE E Protein A 6 FT #SUB 175 175 SER F 186 186 SER E Protein S 1 FT #SUB 179 179 THR F 151 151 LYS E Protein S 1 CC SEQUENCE 211 AA (ATOM); CC DIVLTQSPAI MSAAPGDKVT MTCSASSSVS YIHWYQQKSG TSPKRWIYDT SKLTSGVPVR CC FSGSGSGTSY SLTINTMEAE DAATYYCQQW SSHPQTFGGG TKLEILRADA APTVSIFPPS CC SEQLTSGGAS VVCFLNNFYP KDINVKWKID GSERQNGVLN SWTDQDSKDS TYSMSSTLTL CC TKDEYERHNS YTCEATHKTS TSPIVKSFNR A CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES DIVLTQSPAIMSAAPGDKVTMTCSASSSVSYIHWYQQKSGTSPKRWIYDT CC ATOM DIVLTQSPAIMSAAPGDKVTMTCSASSSVSYIHWYQQKSGTSPKRWIYDT CC ************************************************** CC SEQRES SKLTSGVPVRFSGSGSGTSYSLTINTMEAEDAATYYCQQWSSHPQTFGGG CC ATOM SKLTSGVPVRFSGSGSGTSYSLTINTMEAEDAATYYCQQWSSHPQTFGGG CC ************************************************** CC SEQRES TKLEILRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKID CC ATOM TKLEILRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKID CC ************************************************** CC SEQRES GSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTS CC ATOM GSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTS CC ************************************************** CC SEQRES TSPIVKSFNRA CC ATOM TSPIVKSFNRA CC *********** SQ SEQUENCE 211 AA; MW; CN; DIVLTQSPAI MSAAPGDKVT MTCSASSSVS YIHWYQQKSG TSPKRWIYDT SKLTSGVPVR FSGSGSGTSY SLTINTMEAE DAATYYCQQW SSHPQTFGGG TKLEILRADA APTVSIFPPS SEQLTSGGAS VVCFLNNFYP KDINVKWKID GSERQNGVLN SWTDQDSKDS TYSMSSTLTL TKDEYERHNS YTCEATHKTS TSPIVKSFNR A //