ID 5VEUA STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 309 330 LYS A 384 405 PRO C Protein S 4 FT #SUB 309 330 LYS A 385 406 LYS C Protein S 4 FT #SUB 312 333 LYS A 388 409 THR C Protein S 1 FT #SUB 313 334 GLU A 389 410 GLU C Protein S 4 FT #SUB 317 338 VAL A 389 410 GLU C Protein S 1 FT #SUB 331 352 GLN A 389 410 GLU C Protein B 1 FT #SUB 332 353 MET A 389 410 GLU C Protein B 1 FT #SUB 333 354 GLU A 389 410 GLU C Protein B 2 FT #SUB 385 406 LYS A 46 67 LYS C Protein B 2 FT #SUB 386 407 TYR A 46 67 LYS C Protein B 2 FT #SUB 388 409 THR A 46 67 LYS C Protein S 4 FT #SUB 388 409 THR A 47 68 TYR C Protein S 2 FT #SUB 396 417 GLU A 45 66 LYS C Protein B 4 FT #SUB 397 418 ARG A 45 66 LYS C Protein B 5 FT #SUB 399 420 SER A 45 66 LYS C Protein S 1 FT #SUB 401 422 LYS A 391 412 GLU C Protein S 2 FT #SUB 404 425 SER A 38 59 LYS C Protein S 1 FT #SUB 404 425 SER A 42 63 GLU C Protein S 6 FT #SUB 404 425 SER A 45 66 LYS C Protein S 1 FT #SUB 179 200 GLN A 234 255 ARG D Protein S 2 FT #SUB 184 205 GLU A 230 251 LYS D Protein S 2 FT #SUB 188 209 LYS A 226 247 ASN D Protein S 1 FT #SUB 197 218 PRO A 215 236 LEU D Protein B 2 FT #SUB 198 219 LEU A 215 236 LEU D Protein B 2 FT #SUB 212 233 PHE A 215 236 LEU D Protein S 2 FT #SUB 214 235 ALA A 197 218 PRO D Protein B 2 FT #SUB 215 236 LEU A 197 218 PRO D Protein S 2 FT #SUB 215 236 LEU A 198 219 LEU D Protein S 2 FT #SUB 215 236 LEU A 212 233 PHE D Protein S 2 FT #SUB 217 238 VAL A 217 238 VAL D Protein S 1 FT #SUB 223 244 ASP A 223 244 ASP D Protein A 3 FT #SUB 223 244 ASP A 226 247 ASN D Protein S 3 FT #SUB 226 247 ASN A 188 209 LYS D Protein S 2 FT #SUB 226 247 ASN A 223 244 ASP D Protein S 6 FT #SUB 230 251 LYS A 184 205 GLU D Protein S 3 FT #SUB 234 255 ARG A 179 200 GLN D Protein S 4 FT #SUB 207 228 PHE A 210 231 PRO E Protein S 5 FT #SUB 207 228 PHE A 211 232 VAL E Protein S 5 FT #SUB 207 228 PHE A 214 235 ALA E Protein S 2 FT #SUB 211 232 VAL A 207 228 PHE E Protein A 6 FT #SUB 214 235 ALA A 207 228 PHE E Protein S 2 FT #SUB 13 34 LYS A 389 410 GLU G Protein A 6 FT #SUB 13 34 LYS A 392 413 GLU G Protein S 2 FT #SUB 14 35 ARG A 388 409 THR G Protein S 1 FT #SUB 14 35 ARG A 389 410 GLU G Protein B 6 FT #SUB 14 35 ARG A 390 411 PRO G Protein B 1 FT #SUB 15 36 LEU A 384 405 PRO G Protein B 4 FT #SUB 15 36 LEU A 390 411 PRO G Protein B 1 FT #SUB 16 37 GLY A 390 411 PRO G Protein B 1 FT #SUB 49 70 LYS A 42 63 GLU G Protein S 1 FT #SUB 65 86 ASP A 46 67 LYS G Protein S 2 FT #SUB 67 88 ASP A 46 67 LYS G Protein S 3 FT #SUB 363 384 ASN A 45 66 LYS G Protein A 10 FT #SUB 364 385 GLY A 45 66 LYS G Protein B 1 FT #SUB 364 385 GLY A 385 406 LYS G Protein B 1 FT #SUB 365 386 VAL A 384 405 PRO G Protein S 1 FT #SUB 366 387 PHE A 385 406 LYS G Protein S 3 FT #SUB 23 44 LEU A 30 51 LEU I Protein S 1 FT #SUB 24 45 PRO A 195 216 LEU I Protein S 5 FT #SUB 25 46 LEU A 201 222 SER I Protein S 2 FT #SUB 25 46 LEU A 204 225 LEU I Protein S 1 FT #SUB 26 47 LEU A 26 47 LEU I Protein S 1 FT #SUB 26 47 LEU A 204 225 LEU I Protein S 1 FT #SUB 30 51 LEU A 23 44 LEU I Protein S 1 FT #SUB 30 51 LEU A 26 47 LEU I Protein S 2 FT #SUB 33 54 ARG A 23 44 LEU I Protein S 3 FT #SUB 33 54 ARG A 24 45 PRO I Protein S 3 FT #SUB 195 216 LEU A 25 46 LEU I Protein S 1 FT #SUB 200 221 LEU A 25 46 LEU I Protein S 1 FT #SUB 204 225 LEU A 204 225 LEU I Protein S 1 FT #SUB 204 225 LEU A 205 226 PHE I Protein S 2 FT #SUB 205 226 PHE A 205 226 PHE I Protein S 1 FT #HET 84 105 ARG A 1 601 HEM A S 9 FT #HET 84 105 ARG A 2 602 RIT A S 1 FT #HET 85 106 ARG A 2 602 RIT A S 3 FT #HET 97 118 ILE A 1 601 HEM A A 5 FT #HET 98 119 SER A 1 601 HEM A A 2 FT #HET 98 119 SER A 2 602 RIT A A 4 FT #HET 99 120 LEU A 2 602 RIT A S 2 FT #HET 105 126 TRP A 1 601 HEM A S 5 FT #HET 109 130 ARG A 1 601 HEM A S 4 FT #HET 163 184 ILE A 1 601 HEM A S 1 FT #HET 189 210 PHE A 2 602 RIT A A 8 FT #HET 192 213 PHE A 2 602 RIT A A 8 FT #HET 194 215 PHE A 2 602 RIT A S 2 FT #HET 199 220 PHE A 2 602 RIT A S 1 FT #HET 219 240 LEU A 2 602 RIT A B 1 FT #HET 220 241 PHE A 2 602 RIT A S 7 FT #HET 280 301 ILE A 1 601 HEM A S 1 FT #HET 280 301 ILE A 2 602 RIT A S 2 FT #HET 281 302 PHE A 1 601 HEM A S 4 FT #HET 283 304 PHE A 2 602 RIT A S 10 FT #HET 284 305 ALA A 1 601 HEM A A 7 FT #HET 284 305 ALA A 2 602 RIT A S 1 FT #HET 285 306 GLY A 1 601 HEM A B 2 FT #HET 288 309 THR A 1 601 HEM A S 8 FT #HET 288 309 THR A 2 602 RIT A S 2 FT #HET 292 313 VAL A 1 601 HEM A S 1 FT #HET 343 364 LEU A 1 601 HEM A S 1 FT #HET 348 369 VAL A 1 601 HEM A S 1 FT #HET 349 370 ALA A 1 601 HEM A S 1 FT #HET 349 370 ALA A 2 602 RIT A S 2 FT #HET 352 373 LEU A 1 601 HEM A S 3 FT #HET 354 375 ARG A 1 601 HEM A S 9 FT #HET 412 433 PRO A 1 601 HEM A B 4 FT #HET 413 434 PHE A 1 601 HEM A A 13 FT #HET 414 435 GLY A 1 601 HEM A B 5 FT #HET 415 436 THR A 1 601 HEM A B 1 FT #HET 418 439 ARG A 1 601 HEM A A 12 FT #HET 419 440 ASN A 1 601 HEM A B 4 FT #HET 420 441 CYS A 1 601 HEM A A 24 FT #HET 421 442 ILE A 1 601 HEM A A 5 FT #HET 425 446 PHE A 1 601 HEM A S 2 FT #HET 426 447 ALA A 1 601 HEM A S 2 FT #HET 430 451 MET A 1 601 HEM A S 1 FT #HET 459 480 GLY A 2 602 RIT A B 3 FT #HET 460 481 LEU A 2 602 RIT A S 1 FT DISORDER 1 5 FT DISORDER 261 267 FT DISORDER 475 480 CC SEQUENCE 462 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSALSDL ELAAQSIIFI FAGYETTSSV LSFTLYELAT HPDVQQKLQK CC EIDAVLPNKA PPTYDAVVQM EYLDMVVNET LRLFPVAIRL ERTCKKDVEI NGVFIPKGSM CC VVIPTYALHH DPKYWTEPEE FRPERFSKKK DSIDPYIYTP FGTGPRNCIG MRFALMNMKL CC ALIRVLQNFS FKPCKETQIP LKLDTQGLLQ PEKPIVLKVD SR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ************************************************** CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ************************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUB STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 119 140 GLY B 67 88 ASP E Protein B 5 FT #SUB 122 143 LYS B 49 70 LYS E Protein S 1 FT #SUB 122 143 LYS B 65 86 ASP E Protein S 1 FT #SUB 123 144 GLU B 70 91 ARG E Protein S 1 FT #SUB 123 144 GLU B 71 92 THR E Protein S 1 FT #SUB 184 205 GLU B 230 251 LYS F Protein S 2 FT #SUB 188 209 LYS B 226 247 ASN F Protein S 1 FT #SUB 197 218 PRO B 215 236 LEU F Protein B 1 FT #SUB 198 219 LEU B 215 236 LEU F Protein B 2 FT #SUB 212 233 PHE B 215 236 LEU F Protein S 2 FT #SUB 214 235 ALA B 197 218 PRO F Protein B 2 FT #SUB 215 236 LEU B 197 218 PRO F Protein S 1 FT #SUB 215 236 LEU B 201 222 SER F Protein S 1 FT #SUB 215 236 LEU B 212 233 PHE F Protein S 2 FT #SUB 217 238 VAL B 217 238 VAL F Protein S 3 FT #SUB 223 244 ASP B 226 247 ASN F Protein S 4 FT #SUB 226 247 ASN B 223 244 ASP F Protein S 1 FT #SUB 230 251 LYS B 184 205 GLU F Protein S 2 FT #SUB 207 228 PHE B 210 231 PRO H Protein S 1 FT #SUB 207 228 PHE B 211 232 VAL H Protein S 1 FT #SUB 207 228 PHE B 214 235 ALA H Protein S 2 FT #SUB 210 231 PRO B 207 228 PHE H Protein S 1 FT #SUB 211 232 VAL B 207 228 PHE H Protein A 3 FT #SUB 214 235 ALA B 207 228 PHE H Protein S 2 FT #SUB 23 44 LEU B 30 51 LEU L Protein S 1 FT #SUB 24 45 PRO B 195 216 LEU L Protein S 5 FT #SUB 25 46 LEU B 200 221 LEU L Protein A 3 FT #SUB 25 46 LEU B 201 222 SER L Protein S 1 FT #SUB 26 47 LEU B 204 225 LEU L Protein S 2 FT #SUB 30 51 LEU B 26 47 LEU L Protein S 1 FT #SUB 33 54 ARG B 24 45 PRO L Protein S 2 FT #SUB 195 216 LEU B 24 45 PRO L Protein S 1 FT #SUB 195 216 LEU B 25 46 LEU L Protein S 2 FT #SUB 200 221 LEU B 25 46 LEU L Protein S 1 FT #SUB 200 221 LEU B 205 226 PHE L Protein S 1 FT #SUB 204 225 LEU B 204 225 LEU L Protein S 1 FT #SUB 205 226 PHE B 205 226 PHE L Protein S 1 FT #HET 84 105 ARG B 3 601 HEM B S 9 FT #HET 85 106 ARG B 4 602 RIT B S 8 FT #HET 97 118 ILE B 3 601 HEM B A 4 FT #HET 98 119 SER B 3 601 HEM B A 2 FT #HET 98 119 SER B 4 602 RIT B S 1 FT #HET 99 120 LEU B 4 602 RIT B S 1 FT #HET 105 126 TRP B 3 601 HEM B S 6 FT #HET 109 130 ARG B 3 601 HEM B S 5 FT #HET 163 184 ILE B 3 601 HEM B S 1 FT #HET 189 210 PHE B 4 602 RIT B S 9 FT #HET 194 215 PHE B 4 602 RIT B S 4 FT #HET 220 241 PHE B 4 602 RIT B S 5 FT #HET 280 301 ILE B 4 602 RIT B S 2 FT #HET 281 302 PHE B 3 601 HEM B A 2 FT #HET 283 304 PHE B 4 602 RIT B S 12 FT #HET 284 305 ALA B 3 601 HEM B A 5 FT #HET 284 305 ALA B 4 602 RIT B S 3 FT #HET 285 306 GLY B 3 601 HEM B B 2 FT #HET 288 309 THR B 3 601 HEM B S 6 FT #HET 288 309 THR B 4 602 RIT B S 2 FT #HET 292 313 VAL B 3 601 HEM B S 1 FT #HET 343 364 LEU B 3 601 HEM B S 1 FT #HET 348 369 VAL B 3 601 HEM B S 4 FT #HET 349 370 ALA B 3 601 HEM B S 1 FT #HET 349 370 ALA B 4 602 RIT B S 2 FT #HET 350 371 ILE B 4 602 RIT B S 1 FT #HET 352 373 LEU B 3 601 HEM B S 5 FT #HET 353 374 GLU B 4 602 RIT B S 3 FT #HET 354 375 ARG B 3 601 HEM B S 8 FT #HET 412 433 PRO B 3 601 HEM B B 6 FT #HET 413 434 PHE B 3 601 HEM B A 17 FT #HET 414 435 GLY B 3 601 HEM B B 2 FT #HET 415 436 THR B 3 601 HEM B B 1 FT #HET 418 439 ARG B 3 601 HEM B A 11 FT #HET 419 440 ASN B 3 601 HEM B B 2 FT #HET 420 441 CYS B 3 601 HEM B A 24 FT #HET 421 442 ILE B 3 601 HEM B A 4 FT #HET 422 443 GLY B 3 601 HEM B B 4 FT #HET 425 446 PHE B 3 601 HEM B S 1 FT #HET 426 447 ALA B 3 601 HEM B S 2 FT #HET 430 451 MET B 3 601 HEM B S 1 FT #HET 459 480 GLY B 4 602 RIT B B 5 FT #HET 460 481 LEU B 4 602 RIT B B 1 FT DISORDER 1 5 FT DISORDER 261 267 FT DISORDER 400 403 FT DISORDER 475 480 CC SEQUENCE 458 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSALSDL ELAAQSIIFI FAGYETTSSV LSFTLYELAT HPDVQQKLQK CC EIDAVLPNKA PPTYDAVVQM EYLDMVVNET LRLFPVAIRL ERTCKKDVEI NGVFIPKGSM CC VVIPTYALHH DPKYWTEPEE FRPERFSSID PYIYTPFGTG PRNCIGMRFA LMNMKLALIR CC VLQNFSFKPC KETQIPLKLD TQGLLQPEKP IVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ---SIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC *********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUC STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 38 59 LYS C 404 425 SER A Protein S 1 FT #SUB 42 63 GLU C 404 425 SER A Protein S 6 FT #SUB 45 66 LYS C 396 417 GLU A Protein A 4 FT #SUB 45 66 LYS C 397 418 ARG A Protein A 5 FT #SUB 45 66 LYS C 399 420 SER A Protein S 1 FT #SUB 45 66 LYS C 404 425 SER A Protein S 1 FT #SUB 46 67 LYS C 385 406 LYS A Protein S 2 FT #SUB 46 67 LYS C 386 407 TYR A Protein S 2 FT #SUB 46 67 LYS C 388 409 THR A Protein A 4 FT #SUB 47 68 TYR C 388 409 THR A Protein S 2 FT #SUB 384 405 PRO C 309 330 LYS A Protein B 4 FT #SUB 385 406 LYS C 309 330 LYS A Protein B 4 FT #SUB 388 409 THR C 312 333 LYS A Protein S 1 FT #SUB 389 410 GLU C 313 334 GLU A Protein S 4 FT #SUB 389 410 GLU C 317 338 VAL A Protein S 1 FT #SUB 389 410 GLU C 331 352 GLN A Protein S 1 FT #SUB 389 410 GLU C 332 353 MET A Protein S 1 FT #SUB 389 410 GLU C 333 354 GLU A Protein S 2 FT #SUB 391 412 GLU C 401 422 LYS A Protein S 2 FT #SUB 23 44 LEU C 33 54 ARG G Protein S 2 FT #SUB 24 45 PRO C 33 54 ARG G Protein S 2 FT #SUB 24 45 PRO C 195 216 LEU G Protein S 2 FT #SUB 25 46 LEU C 200 221 LEU G Protein S 1 FT #SUB 26 47 LEU C 26 47 LEU G Protein S 2 FT #SUB 30 51 LEU C 23 44 LEU G Protein S 4 FT #SUB 195 216 LEU C 24 45 PRO G Protein A 5 FT #SUB 197 218 PRO C 25 46 LEU G Protein S 1 FT #SUB 204 225 LEU C 25 46 LEU G Protein S 1 FT #SUB 204 225 LEU C 26 47 LEU G Protein S 2 FT #SUB 204 225 LEU C 204 225 LEU G Protein S 1 FT #SUB 205 226 PHE C 200 221 LEU G Protein S 2 FT #SUB 205 226 PHE C 204 225 LEU G Protein S 2 FT #SUB 205 226 PHE C 205 226 PHE G Protein S 1 FT #SUB 207 228 PHE C 211 232 VAL J Protein S 3 FT #SUB 207 228 PHE C 214 235 ALA J Protein S 2 FT #SUB 211 232 VAL C 207 228 PHE J Protein S 3 FT #SUB 211 232 VAL C 211 232 VAL J Protein S 1 FT #SUB 214 235 ALA C 207 228 PHE J Protein S 3 FT #SUB 179 200 GLN C 234 255 ARG K Protein A 6 FT #SUB 184 205 GLU C 234 255 ARG K Protein S 5 FT #SUB 212 233 PHE C 215 236 LEU K Protein S 3 FT #SUB 215 236 LEU C 212 233 PHE K Protein S 1 FT #SUB 215 236 LEU C 215 236 LEU K Protein S 1 FT #SUB 223 244 ASP C 223 244 ASP K Protein S 2 FT #SUB 223 244 ASP C 226 247 ASN K Protein S 4 FT #SUB 226 247 ASN C 223 244 ASP K Protein S 3 FT #SUB 230 251 LYS C 184 205 GLU K Protein S 1 FT #SUB 234 255 ARG C 179 200 GLN K Protein S 1 FT #SUB 234 255 ARG C 184 205 GLU K Protein S 3 FT #HET 84 105 ARG C 5 601 HEM C S 8 FT #HET 97 118 ILE C 5 601 HEM C A 5 FT #HET 98 119 SER C 5 601 HEM C B 1 FT #HET 105 126 TRP C 5 601 HEM C S 6 FT #HET 109 130 ARG C 5 601 HEM C S 6 FT #HET 163 184 ILE C 5 601 HEM C S 1 FT #HET 281 302 PHE C 5 601 HEM C A 4 FT #HET 284 305 ALA C 5 601 HEM C A 8 FT #HET 285 306 GLY C 5 601 HEM C B 2 FT #HET 288 309 THR C 5 601 HEM C S 9 FT #HET 292 313 VAL C 5 601 HEM C S 1 FT #HET 348 369 VAL C 5 601 HEM C S 1 FT #HET 349 370 ALA C 5 601 HEM C S 2 FT #HET 352 373 LEU C 5 601 HEM C S 4 FT #HET 354 375 ARG C 5 601 HEM C S 9 FT #HET 412 433 PRO C 5 601 HEM C B 3 FT #HET 413 434 PHE C 5 601 HEM C A 13 FT #HET 414 435 GLY C 5 601 HEM C B 2 FT #HET 418 439 ARG C 5 601 HEM C A 14 FT #HET 419 440 ASN C 5 601 HEM C B 5 FT #HET 420 441 CYS C 5 601 HEM C A 24 FT #HET 421 442 ILE C 5 601 HEM C A 5 FT #HET 422 443 GLY C 5 601 HEM C B 4 FT #HET 425 446 PHE C 5 601 HEM C S 1 FT #HET 426 447 ALA C 5 601 HEM C S 2 FT #HET 430 451 MET C 5 601 HEM C S 1 FT DISORDER 1 5 FT DISORDER 475 480 CC SEQUENCE 469 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSKETES HKALSDLELA AQSIIFIFAG YETTSSVLSF TLYELATHPD CC VQQKLQKEID AVLPNKAPPT YDAVVQMEYL DMVVNETLRL FPVAIRLERT CKKDVEINGV CC FIPKGSMVVI PTYALHHDPK YWTEPEEFRP ERFSKKKDSI DPYIYTPFGT GPRNCIGMRF CC ALMNMKLALI RVLQNFSFKP CKETQIPLKL DTQGLLQPEK PIVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ************************************************** CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ************************************************** CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ************************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUD STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 179 200 GLN D 234 255 ARG A Protein S 4 FT #SUB 184 205 GLU D 230 251 LYS A Protein S 3 FT #SUB 188 209 LYS D 226 247 ASN A Protein S 2 FT #SUB 197 218 PRO D 214 235 ALA A Protein S 2 FT #SUB 197 218 PRO D 215 236 LEU A Protein B 2 FT #SUB 198 219 LEU D 215 236 LEU A Protein B 2 FT #SUB 212 233 PHE D 215 236 LEU A Protein S 2 FT #SUB 215 236 LEU D 197 218 PRO A Protein S 2 FT #SUB 215 236 LEU D 198 219 LEU A Protein S 2 FT #SUB 215 236 LEU D 212 233 PHE A Protein S 2 FT #SUB 217 238 VAL D 217 238 VAL A Protein S 1 FT #SUB 223 244 ASP D 223 244 ASP A Protein A 3 FT #SUB 223 244 ASP D 226 247 ASN A Protein S 6 FT #SUB 226 247 ASN D 188 209 LYS A Protein S 1 FT #SUB 226 247 ASN D 223 244 ASP A Protein S 3 FT #SUB 230 251 LYS D 184 205 GLU A Protein S 2 FT #SUB 234 255 ARG D 179 200 GLN A Protein S 2 FT #SUB 23 44 LEU D 30 51 LEU E Protein S 1 FT #SUB 24 45 PRO D 195 216 LEU E Protein S 3 FT #SUB 24 45 PRO D 200 221 LEU E Protein S 1 FT #SUB 25 46 LEU D 200 221 LEU E Protein A 2 FT #SUB 25 46 LEU D 201 222 SER E Protein S 3 FT #SUB 25 46 LEU D 204 225 LEU E Protein S 1 FT #SUB 26 47 LEU D 26 47 LEU E Protein S 1 FT #SUB 26 47 LEU D 204 225 LEU E Protein S 1 FT #SUB 30 51 LEU D 24 45 PRO E Protein S 2 FT #SUB 33 54 ARG D 24 45 PRO E Protein S 2 FT #SUB 195 216 LEU D 25 46 LEU E Protein S 1 FT #SUB 200 221 LEU D 25 46 LEU E Protein S 1 FT #SUB 204 225 LEU D 205 226 PHE E Protein S 2 FT #SUB 207 228 PHE D 211 232 VAL I Protein S 4 FT #SUB 207 228 PHE D 214 235 ALA I Protein S 2 FT #SUB 211 232 VAL D 211 232 VAL I Protein S 1 FT #SUB 214 235 ALA D 207 228 PHE I Protein S 2 FT #HET 84 105 ARG D 6 601 HEM D S 10 FT #HET 97 118 ILE D 6 601 HEM D A 2 FT #HET 98 119 SER D 6 601 HEM D A 3 FT #HET 105 126 TRP D 6 601 HEM D S 5 FT #HET 109 130 ARG D 6 601 HEM D S 4 FT #HET 116 137 PHE D 6 601 HEM D S 2 FT #HET 163 184 ILE D 6 601 HEM D S 1 FT #HET 281 302 PHE D 6 601 HEM D S 2 FT #HET 284 305 ALA D 6 601 HEM D A 6 FT #HET 285 306 GLY D 6 601 HEM D B 2 FT #HET 288 309 THR D 6 601 HEM D S 9 FT #HET 292 313 VAL D 6 601 HEM D S 1 FT #HET 343 364 LEU D 6 601 HEM D S 1 FT #HET 349 370 ALA D 6 601 HEM D S 1 FT #HET 352 373 LEU D 6 601 HEM D S 4 FT #HET 354 375 ARG D 6 601 HEM D S 9 FT #HET 412 433 PRO D 6 601 HEM D B 3 FT #HET 413 434 PHE D 6 601 HEM D A 12 FT #HET 414 435 GLY D 6 601 HEM D B 1 FT #HET 418 439 ARG D 6 601 HEM D A 11 FT #HET 419 440 ASN D 6 601 HEM D B 3 FT #HET 420 441 CYS D 6 601 HEM D A 25 FT #HET 421 442 ILE D 6 601 HEM D S 3 FT #HET 422 443 GLY D 6 601 HEM D B 1 FT #HET 425 446 PHE D 6 601 HEM D S 3 FT #HET 426 447 ALA D 6 601 HEM D S 2 FT DISORDER 1 5 FT DISORDER 261 267 FT DISORDER 400 402 FT DISORDER 475 480 CC SEQUENCE 459 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSALSDL ELAAQSIIFI FAGYETTSSV LSFTLYELAT HPDVQQKLQK CC EIDAVLPNKA PPTYDAVVQM EYLDMVVNET LRLFPVAIRL ERTCKKDVEI NGVFIPKGSM CC VVIPTYALHH DPKYWTEPEE FRPERFSDSI DPYIYTPFGT GPRNCIGMRF ALMNMKLALI CC RVLQNFSFKP CKETQIPLKL DTQGLLQPEK PIVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM --DSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ************************************************ CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUE STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 207 228 PHE E 211 232 VAL A Protein A 6 FT #SUB 207 228 PHE E 214 235 ALA A Protein S 2 FT #SUB 210 231 PRO E 207 228 PHE A Protein A 5 FT #SUB 211 232 VAL E 207 228 PHE A Protein A 5 FT #SUB 214 235 ALA E 207 228 PHE A Protein S 2 FT #SUB 49 70 LYS E 122 143 LYS B Protein S 1 FT #SUB 65 86 ASP E 122 143 LYS B Protein S 1 FT #SUB 67 88 ASP E 119 140 GLY B Protein S 5 FT #SUB 70 91 ARG E 123 144 GLU B Protein S 1 FT #SUB 71 92 THR E 123 144 GLU B Protein S 1 FT #SUB 24 45 PRO E 30 51 LEU D Protein S 2 FT #SUB 24 45 PRO E 33 54 ARG D Protein S 2 FT #SUB 25 46 LEU E 195 216 LEU D Protein S 1 FT #SUB 25 46 LEU E 200 221 LEU D Protein S 1 FT #SUB 26 47 LEU E 26 47 LEU D Protein S 1 FT #SUB 30 51 LEU E 23 44 LEU D Protein S 1 FT #SUB 195 216 LEU E 24 45 PRO D Protein A 3 FT #SUB 200 221 LEU E 24 45 PRO D Protein S 1 FT #SUB 200 221 LEU E 25 46 LEU D Protein S 2 FT #SUB 201 222 SER E 25 46 LEU D Protein A 3 FT #SUB 204 225 LEU E 25 46 LEU D Protein S 1 FT #SUB 204 225 LEU E 26 47 LEU D Protein S 1 FT #SUB 205 226 PHE E 204 225 LEU D Protein S 2 FT #SUB 212 233 PHE E 215 236 LEU I Protein S 1 FT #SUB 215 236 LEU E 212 233 PHE I Protein S 3 FT #SUB 215 236 LEU E 215 236 LEU I Protein S 1 FT #SUB 226 247 ASN E 223 244 ASP I Protein S 3 FT #SUB 234 255 ARG E 179 200 GLN I Protein S 8 FT #HET 84 105 ARG E 7 601 HEM E S 12 FT #HET 97 118 ILE E 7 601 HEM E A 4 FT #HET 98 119 SER E 7 601 HEM E B 1 FT #HET 105 126 TRP E 7 601 HEM E S 6 FT #HET 109 130 ARG E 7 601 HEM E S 4 FT #HET 163 184 ILE E 7 601 HEM E S 1 FT #HET 281 302 PHE E 7 601 HEM E S 4 FT #HET 284 305 ALA E 7 601 HEM E A 6 FT #HET 285 306 GLY E 7 601 HEM E B 2 FT #HET 288 309 THR E 7 601 HEM E A 8 FT #HET 292 313 VAL E 7 601 HEM E S 1 FT #HET 343 364 LEU E 7 601 HEM E S 1 FT #HET 349 370 ALA E 7 601 HEM E S 1 FT #HET 352 373 LEU E 7 601 HEM E S 1 FT #HET 354 375 ARG E 7 601 HEM E S 9 FT #HET 412 433 PRO E 7 601 HEM E B 5 FT #HET 413 434 PHE E 7 601 HEM E A 10 FT #HET 414 435 GLY E 7 601 HEM E B 2 FT #HET 418 439 ARG E 7 601 HEM E A 10 FT #HET 419 440 ASN E 7 601 HEM E B 3 FT #HET 420 441 CYS E 7 601 HEM E A 25 FT #HET 421 442 ILE E 7 601 HEM E A 4 FT #HET 426 447 ALA E 7 601 HEM E S 1 FT #HET 430 451 MET E 7 601 HEM E S 1 FT DISORDER 1 5 FT DISORDER 145 147 FT DISORDER 242 247 FT DISORDER 259 267 FT DISORDER 400 404 FT DISORDER 470 480 CC SEQUENCE 441 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEP VTLKDIFGAY SMDVITGTSF GVNIDSLNNP QDPFVESTKK CC FLKFGFLDPL FLSIILFPFL TPVFEALNVS LFPKDTINFL SKSVNRMKKS RLNLDFLQLM CC IDSQALSDLE LAAQSIIFIF AGYETTSSVL SFTLYELATH PDVQQKLQKE IDAVLPNKAP CC PTYDAVVQME YLDMVVNETL RLFPVAIRLE RTCKKDVEIN GVFIPKGSMV VIPTYALHHD CC PKYWTEPEEF RPERFSIDPY IYTPFGTGPR NCIGMRFALM NMKLALIRVL QNFSFKPCKE CC TQIPLKLDTQ GLLQPEKPIV L CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAE---PVT CC ******************************************** *** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLN------LDF CC ***************************************** *** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQ---------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ******** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ----IDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVL----------- CC ******************* SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUF STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 184 205 GLU F 230 251 LYS B Protein S 2 FT #SUB 197 218 PRO F 214 235 ALA B Protein S 2 FT #SUB 197 218 PRO F 215 236 LEU B Protein B 1 FT #SUB 201 222 SER F 215 236 LEU B Protein S 1 FT #SUB 212 233 PHE F 215 236 LEU B Protein S 2 FT #SUB 215 236 LEU F 197 218 PRO B Protein S 1 FT #SUB 215 236 LEU F 198 219 LEU B Protein S 2 FT #SUB 215 236 LEU F 212 233 PHE B Protein S 2 FT #SUB 217 238 VAL F 217 238 VAL B Protein S 3 FT #SUB 223 244 ASP F 226 247 ASN B Protein S 1 FT #SUB 226 247 ASN F 188 209 LYS B Protein S 1 FT #SUB 226 247 ASN F 223 244 ASP B Protein S 4 FT #SUB 230 251 LYS F 184 205 GLU B Protein S 2 FT #SUB 23 44 LEU F 30 51 LEU H Protein S 2 FT #SUB 24 45 PRO F 195 216 LEU H Protein S 4 FT #SUB 25 46 LEU F 200 221 LEU H Protein S 1 FT #SUB 26 47 LEU F 25 46 LEU H Protein S 1 FT #SUB 26 47 LEU F 26 47 LEU H Protein S 1 FT #SUB 26 47 LEU F 204 225 LEU H Protein S 1 FT #SUB 30 51 LEU F 26 47 LEU H Protein S 2 FT #SUB 195 216 LEU F 24 45 PRO H Protein S 2 FT #SUB 200 221 LEU F 25 46 LEU H Protein S 1 FT #SUB 315 336 ASP F 110 131 SER K Protein B 1 FT #SUB 319 340 PRO F 110 131 SER K Protein S 5 FT #SUB 319 340 PRO F 111 132 LEU K Protein S 2 FT #SUB 320 341 ASN F 111 132 LEU K Protein S 1 FT #SUB 320 341 ASN F 257 278 SER K Protein S 1 FT #SUB 320 341 ASN F 268 289 ALA K Protein S 3 FT #SUB 207 228 PHE F 214 235 ALA L Protein S 6 FT #SUB 210 231 PRO F 207 228 PHE L Protein B 1 FT #SUB 211 232 VAL F 207 228 PHE L Protein A 2 FT #SUB 211 232 VAL F 211 232 VAL L Protein S 1 FT #SUB 214 235 ALA F 207 228 PHE L Protein S 4 FT #HET 84 105 ARG F 8 601 HEM F S 9 FT #HET 97 118 ILE F 8 601 HEM F A 4 FT #HET 98 119 SER F 8 601 HEM F B 1 FT #HET 105 126 TRP F 8 601 HEM F S 4 FT #HET 109 130 ARG F 8 601 HEM F S 4 FT #HET 116 137 PHE F 8 601 HEM F S 2 FT #HET 163 184 ILE F 8 601 HEM F S 1 FT #HET 281 302 PHE F 8 601 HEM F A 3 FT #HET 284 305 ALA F 8 601 HEM F A 11 FT #HET 285 306 GLY F 8 601 HEM F B 2 FT #HET 288 309 THR F 8 601 HEM F S 9 FT #HET 292 313 VAL F 8 601 HEM F S 1 FT #HET 349 370 ALA F 8 601 HEM F S 1 FT #HET 352 373 LEU F 8 601 HEM F S 4 FT #HET 354 375 ARG F 8 601 HEM F S 9 FT #HET 412 433 PRO F 8 601 HEM F B 6 FT #HET 413 434 PHE F 8 601 HEM F A 15 FT #HET 418 439 ARG F 8 601 HEM F A 10 FT #HET 419 440 ASN F 8 601 HEM F B 5 FT #HET 420 441 CYS F 8 601 HEM F A 21 FT #HET 421 442 ILE F 8 601 HEM F S 2 FT #HET 422 443 GLY F 8 601 HEM F B 1 FT #HET 425 446 PHE F 8 601 HEM F S 1 FT #HET 426 447 ALA F 8 601 HEM F S 3 FT #HET 430 451 MET F 8 601 HEM F S 1 FT DISORDER 1 7 FT DISORDER 261 267 FT DISORDER 400 403 FT DISORDER 475 480 CC SEQUENCE 456 AA (ATOM); CC THGLFKRLGI PGPTPLPLLG NVLSYRQGLW KFDTECYKKY GKMWGTYEGQ LPVLAITDPD CC VIRTVLVKEC YSVFTNRRSL GPVGFMKSAI SLAEDEEWKR IRSLLSPTFT SGKLKEMFPI CC IAQYGDVLVR NLRREAEKGK PVTLKDIFGA YSMDVITGTS FGVNIDSLNN PQDPFVESTK CC KFLKFGFLDP LFLSIILFPF LTPVFEALNV SLFPKDTINF LSKSVNRMKK SRLNDKQKHR CC LDFLQLMIDS QNSALSDLEL AAQSIIFIFA GYETTSSVLS FTLYELATHP DVQQKLQKEI CC DAVLPNKAPP TYDAVVQMEY LDMVVNETLR LFPVAIRLER TCKKDVEING VFIPKGSMVV CC IPTYALHHDP KYWTEPEEFR PERFSSIDPY IYTPFGTGPR NCIGMRFALM NMKLALIRVL CC QNFSFKPCKE TQIPLKLDTQ GLLQPEKPIV LKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -------THGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ******************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ---SIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC *********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUG STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 42 63 GLU G 49 70 LYS A Protein S 1 FT #SUB 45 66 LYS G 363 384 ASN A Protein A 10 FT #SUB 45 66 LYS G 364 385 GLY A Protein B 1 FT #SUB 46 67 LYS G 65 86 ASP A Protein S 2 FT #SUB 46 67 LYS G 67 88 ASP A Protein S 3 FT #SUB 384 405 PRO G 15 36 LEU A Protein S 4 FT #SUB 384 405 PRO G 365 386 VAL A Protein S 1 FT #SUB 385 406 LYS G 364 385 GLY A Protein S 1 FT #SUB 385 406 LYS G 366 387 PHE A Protein S 3 FT #SUB 388 409 THR G 14 35 ARG A Protein S 1 FT #SUB 389 410 GLU G 13 34 LYS A Protein A 6 FT #SUB 389 410 GLU G 14 35 ARG A Protein A 6 FT #SUB 390 411 PRO G 14 35 ARG A Protein S 1 FT #SUB 390 411 PRO G 15 36 LEU A Protein S 1 FT #SUB 390 411 PRO G 16 37 GLY A Protein S 1 FT #SUB 392 413 GLU G 13 34 LYS A Protein S 2 FT #SUB 23 44 LEU G 30 51 LEU C Protein S 4 FT #SUB 24 45 PRO G 195 216 LEU C Protein S 5 FT #SUB 25 46 LEU G 197 218 PRO C Protein S 1 FT #SUB 25 46 LEU G 204 225 LEU C Protein S 1 FT #SUB 26 47 LEU G 26 47 LEU C Protein S 2 FT #SUB 26 47 LEU G 204 225 LEU C Protein S 2 FT #SUB 33 54 ARG G 23 44 LEU C Protein S 2 FT #SUB 33 54 ARG G 24 45 PRO C Protein S 2 FT #SUB 195 216 LEU G 24 45 PRO C Protein S 2 FT #SUB 200 221 LEU G 25 46 LEU C Protein S 1 FT #SUB 200 221 LEU G 205 226 PHE C Protein S 2 FT #SUB 204 225 LEU G 204 225 LEU C Protein S 1 FT #SUB 204 225 LEU G 205 226 PHE C Protein S 2 FT #SUB 205 226 PHE G 205 226 PHE C Protein S 1 FT #SUB 474 495 ARG G 447 468 LYS I Protein A 5 FT #SUB 179 200 GLN G 234 255 ARG J Protein S 1 FT #SUB 188 209 LYS G 226 247 ASN J Protein S 1 FT #SUB 197 218 PRO G 214 235 ALA J Protein S 1 FT #SUB 197 218 PRO G 215 236 LEU J Protein A 3 FT #SUB 198 219 LEU G 215 236 LEU J Protein B 1 FT #SUB 212 233 PHE G 215 236 LEU J Protein S 2 FT #SUB 214 235 ALA G 197 218 PRO J Protein B 2 FT #SUB 215 236 LEU G 197 218 PRO J Protein S 3 FT #SUB 215 236 LEU G 198 219 LEU J Protein S 1 FT #SUB 215 236 LEU G 212 233 PHE J Protein S 2 FT #SUB 217 238 VAL G 217 238 VAL J Protein S 2 FT #SUB 222 243 LYS G 222 243 LYS J Protein S 1 FT #SUB 223 244 ASP G 223 244 ASP J Protein S 1 FT #SUB 223 244 ASP G 226 247 ASN J Protein S 6 FT #SUB 226 247 ASN G 223 244 ASP J Protein S 7 FT #SUB 230 251 LYS G 184 205 GLU J Protein S 2 FT #SUB 234 255 ARG G 179 200 GLN J Protein S 3 FT #SUB 207 228 PHE G 210 231 PRO K Protein S 5 FT #SUB 207 228 PHE G 211 232 VAL K Protein S 4 FT #SUB 207 228 PHE G 214 235 ALA K Protein S 2 FT #SUB 211 232 VAL G 207 228 PHE K Protein A 3 FT #SUB 211 232 VAL G 211 232 VAL K Protein S 1 FT #SUB 214 235 ALA G 207 228 PHE K Protein S 2 FT #HET 84 105 ARG G 9 601 HEM G S 10 FT #HET 97 118 ILE G 9 601 HEM G A 6 FT #HET 98 119 SER G 9 601 HEM G A 3 FT #HET 105 126 TRP G 9 601 HEM G S 5 FT #HET 109 130 ARG G 9 601 HEM G S 5 FT #HET 163 184 ILE G 9 601 HEM G S 1 FT #HET 281 302 PHE G 9 601 HEM G S 3 FT #HET 284 305 ALA G 9 601 HEM G S 5 FT #HET 285 306 GLY G 9 601 HEM G B 1 FT #HET 288 309 THR G 9 601 HEM G A 7 FT #HET 292 313 VAL G 9 601 HEM G S 1 FT #HET 348 369 VAL G 9 601 HEM G S 1 FT #HET 349 370 ALA G 9 601 HEM G S 1 FT #HET 352 373 LEU G 9 601 HEM G S 4 FT #HET 354 375 ARG G 9 601 HEM G S 8 FT #HET 412 433 PRO G 9 601 HEM G B 3 FT #HET 413 434 PHE G 9 601 HEM G A 12 FT #HET 414 435 GLY G 9 601 HEM G B 2 FT #HET 415 436 THR G 9 601 HEM G B 1 FT #HET 418 439 ARG G 9 601 HEM G A 13 FT #HET 419 440 ASN G 9 601 HEM G B 5 FT #HET 420 441 CYS G 9 601 HEM G A 27 FT #HET 421 442 ILE G 9 601 HEM G S 2 FT #HET 422 443 GLY G 9 601 HEM G B 1 FT #HET 425 446 PHE G 9 601 HEM G S 2 FT #HET 426 447 ALA G 9 601 HEM G S 2 FT #HET 430 451 MET G 9 601 HEM G S 1 FT DISORDER 1 5 FT DISORDER 244 246 FT DISORDER 261 267 FT DISORDER 400 403 FT DISORDER 475 480 CC SEQUENCE 455 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKRL CC DFLQLMIDSQ NSALSDLELA AQSIIFIFAG YETTSSVLSF TLYELATHPD VQQKLQKEID CC AVLPNKAPPT YDAVVQMEYL DMVVNETLRL FPVAIRLERT CKKDVEINGV FIPKGSMVVI CC PTYALHHDPK YWTEPEEFRP ERFSSIDPYI YTPFGTGPRN CIGMRFALMN MKLALIRVLQ CC NFSFKPCKET QIPLKLDTQG LLQPEKPIVL KVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDK---RLDF CC ******************************************* **** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ---SIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC *********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUH STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 207 228 PHE H 210 231 PRO B Protein S 1 FT #SUB 207 228 PHE H 211 232 VAL B Protein S 3 FT #SUB 207 228 PHE H 214 235 ALA B Protein S 2 FT #SUB 210 231 PRO H 207 228 PHE B Protein S 1 FT #SUB 211 232 VAL H 207 228 PHE B Protein S 1 FT #SUB 214 235 ALA H 207 228 PHE B Protein S 2 FT #SUB 24 45 PRO H 195 216 LEU F Protein S 2 FT #SUB 25 46 LEU H 26 47 LEU F Protein S 1 FT #SUB 25 46 LEU H 200 221 LEU F Protein S 1 FT #SUB 26 47 LEU H 26 47 LEU F Protein S 1 FT #SUB 26 47 LEU H 30 51 LEU F Protein S 2 FT #SUB 30 51 LEU H 23 44 LEU F Protein S 2 FT #SUB 195 216 LEU H 24 45 PRO F Protein A 4 FT #SUB 200 221 LEU H 25 46 LEU F Protein S 1 FT #SUB 204 225 LEU H 26 47 LEU F Protein S 1 FT #SUB 212 233 PHE H 215 236 LEU L Protein S 1 FT #SUB 215 236 LEU H 212 233 PHE L Protein S 1 FT #SUB 215 236 LEU H 215 236 LEU L Protein S 1 FT #SUB 217 238 VAL H 215 236 LEU L Protein S 1 FT #HET 84 105 ARG H 10 601 HEM H S 11 FT #HET 84 105 ARG H 11 602 RIT H S 8 FT #HET 85 106 ARG H 11 602 RIT H S 1 FT #HET 97 118 ILE H 10 601 HEM H S 3 FT #HET 98 119 SER H 10 601 HEM H B 1 FT #HET 98 119 SER H 11 602 RIT H S 2 FT #HET 99 120 LEU H 11 602 RIT H S 1 FT #HET 105 126 TRP H 10 601 HEM H S 3 FT #HET 109 130 ARG H 10 601 HEM H S 5 FT #HET 163 184 ILE H 10 601 HEM H S 1 FT #HET 189 210 PHE H 11 602 RIT H S 5 FT #HET 192 213 PHE H 11 602 RIT H A 5 FT #HET 193 214 GLY H 11 602 RIT H B 1 FT #HET 199 220 PHE H 11 602 RIT H S 3 FT #HET 219 240 LEU H 11 602 RIT H A 6 FT #HET 220 241 PHE H 11 602 RIT H S 2 FT #HET 280 301 ILE H 11 602 RIT H S 3 FT #HET 281 302 PHE H 10 601 HEM H A 6 FT #HET 283 304 PHE H 11 602 RIT H S 12 FT #HET 284 305 ALA H 10 601 HEM H A 8 FT #HET 284 305 ALA H 11 602 RIT H S 4 FT #HET 285 306 GLY H 10 601 HEM H B 2 FT #HET 288 309 THR H 10 601 HEM H S 7 FT #HET 288 309 THR H 11 602 RIT H S 2 FT #HET 292 313 VAL H 10 601 HEM H S 1 FT #HET 343 364 LEU H 10 601 HEM H S 1 FT #HET 348 369 VAL H 10 601 HEM H S 4 FT #HET 349 370 ALA H 10 601 HEM H S 1 FT #HET 352 373 LEU H 10 601 HEM H S 5 FT #HET 353 374 GLU H 11 602 RIT H S 3 FT #HET 354 375 ARG H 10 601 HEM H S 7 FT #HET 412 433 PRO H 10 601 HEM H B 6 FT #HET 413 434 PHE H 10 601 HEM H A 9 FT #HET 414 435 GLY H 10 601 HEM H B 1 FT #HET 418 439 ARG H 10 601 HEM H A 13 FT #HET 420 441 CYS H 10 601 HEM H A 24 FT #HET 421 442 ILE H 10 601 HEM H S 4 FT #HET 422 443 GLY H 10 601 HEM H B 1 FT #HET 425 446 PHE H 10 601 HEM H S 1 FT #HET 426 447 ALA H 10 601 HEM H S 2 FT #HET 430 451 MET H 10 601 HEM H S 1 FT #HET 459 480 GLY H 11 602 RIT H B 4 FT #HET 460 481 LEU H 11 602 RIT H A 5 FT DISORDER 1 5 FT DISORDER 261 267 FT DISORDER 400 402 FT DISORDER 475 480 CC SEQUENCE 459 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSALSDL ELAAQSIIFI FAGYETTSSV LSFTLYELAT HPDVQQKLQK CC EIDAVLPNKA PPTYDAVVQM EYLDMVVNET LRLFPVAIRL ERTCKKDVEI NGVFIPKGSM CC VVIPTYALHH DPKYWTEPEE FRPERFSDSI DPYIYTPFGT GPRNCIGMRF ALMNMKLALI CC RVLQNFSFKP CKETQIPLKL DTQGLLQPEK PIVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM --DSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ************************************************ CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUI STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 23 44 LEU I 30 51 LEU A Protein S 1 FT #SUB 23 44 LEU I 33 54 ARG A Protein S 3 FT #SUB 24 45 PRO I 33 54 ARG A Protein S 3 FT #SUB 25 46 LEU I 195 216 LEU A Protein S 1 FT #SUB 25 46 LEU I 200 221 LEU A Protein S 1 FT #SUB 26 47 LEU I 26 47 LEU A Protein S 1 FT #SUB 26 47 LEU I 30 51 LEU A Protein S 2 FT #SUB 30 51 LEU I 23 44 LEU A Protein S 1 FT #SUB 195 216 LEU I 24 45 PRO A Protein A 5 FT #SUB 201 222 SER I 25 46 LEU A Protein B 2 FT #SUB 204 225 LEU I 25 46 LEU A Protein S 1 FT #SUB 204 225 LEU I 26 47 LEU A Protein S 1 FT #SUB 204 225 LEU I 204 225 LEU A Protein S 1 FT #SUB 205 226 PHE I 204 225 LEU A Protein S 2 FT #SUB 205 226 PHE I 205 226 PHE A Protein S 1 FT #SUB 207 228 PHE I 214 235 ALA D Protein S 2 FT #SUB 211 232 VAL I 207 228 PHE D Protein A 4 FT #SUB 211 232 VAL I 211 232 VAL D Protein S 1 FT #SUB 214 235 ALA I 207 228 PHE D Protein S 2 FT #SUB 179 200 GLN I 234 255 ARG E Protein S 8 FT #SUB 212 233 PHE I 215 236 LEU E Protein S 3 FT #SUB 215 236 LEU I 212 233 PHE E Protein S 1 FT #SUB 215 236 LEU I 215 236 LEU E Protein S 1 FT #SUB 223 244 ASP I 226 247 ASN E Protein S 3 FT #SUB 447 468 LYS I 474 495 ARG G Protein S 5 FT #HET 84 105 ARG I 12 601 HEM I S 12 FT #HET 97 118 ILE I 12 601 HEM I A 4 FT #HET 98 119 SER I 12 601 HEM I B 1 FT #HET 105 126 TRP I 12 601 HEM I S 6 FT #HET 109 130 ARG I 12 601 HEM I S 5 FT #HET 163 184 ILE I 12 601 HEM I S 1 FT #HET 281 302 PHE I 12 601 HEM I A 5 FT #HET 284 305 ALA I 12 601 HEM I A 8 FT #HET 285 306 GLY I 12 601 HEM I B 2 FT #HET 288 309 THR I 12 601 HEM I S 7 FT #HET 292 313 VAL I 12 601 HEM I S 1 FT #HET 348 369 VAL I 12 601 HEM I S 1 FT #HET 349 370 ALA I 12 601 HEM I S 1 FT #HET 352 373 LEU I 12 601 HEM I S 2 FT #HET 354 375 ARG I 12 601 HEM I S 9 FT #HET 412 433 PRO I 12 601 HEM I B 3 FT #HET 413 434 PHE I 12 601 HEM I A 9 FT #HET 414 435 GLY I 12 601 HEM I B 2 FT #HET 415 436 THR I 12 601 HEM I B 1 FT #HET 418 439 ARG I 12 601 HEM I A 13 FT #HET 419 440 ASN I 12 601 HEM I B 6 FT #HET 420 441 CYS I 12 601 HEM I A 25 FT #HET 421 442 ILE I 12 601 HEM I A 5 FT #HET 422 443 GLY I 12 601 HEM I B 1 FT #HET 425 446 PHE I 12 601 HEM I S 1 FT #HET 426 447 ALA I 12 601 HEM I S 2 FT #HET 430 451 MET I 12 601 HEM I S 1 FT DISORDER 1 5 FT DISORDER 400 404 FT DISORDER 475 480 CC SEQUENCE 464 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSKETES HKALSDLELA AQSIIFIFAG YETTSSVLSF TLYELATHPD CC VQQKLQKEID AVLPNKAPPT YDAVVQMEYL DMVVNETLRL FPVAIRLERT CKKDVEINGV CC FIPKGSMVVI PTYALHHDPK YWTEPEEFRP ERFSIDPYIY TPFGTGPRNC IGMRFALMNM CC KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ************************************************** CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ----IDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUJ STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 207 228 PHE J 211 232 VAL C Protein A 3 FT #SUB 207 228 PHE J 214 235 ALA C Protein S 3 FT #SUB 211 232 VAL J 207 228 PHE C Protein A 3 FT #SUB 211 232 VAL J 211 232 VAL C Protein S 1 FT #SUB 214 235 ALA J 207 228 PHE C Protein S 2 FT #SUB 179 200 GLN J 234 255 ARG G Protein S 3 FT #SUB 184 205 GLU J 230 251 LYS G Protein S 2 FT #SUB 197 218 PRO J 214 235 ALA G Protein S 2 FT #SUB 197 218 PRO J 215 236 LEU G Protein A 3 FT #SUB 198 219 LEU J 215 236 LEU G Protein B 1 FT #SUB 212 233 PHE J 215 236 LEU G Protein S 2 FT #SUB 214 235 ALA J 197 218 PRO G Protein B 1 FT #SUB 215 236 LEU J 197 218 PRO G Protein S 3 FT #SUB 215 236 LEU J 198 219 LEU G Protein S 1 FT #SUB 215 236 LEU J 212 233 PHE G Protein S 2 FT #SUB 217 238 VAL J 217 238 VAL G Protein S 2 FT #SUB 222 243 LYS J 222 243 LYS G Protein S 1 FT #SUB 223 244 ASP J 223 244 ASP G Protein B 1 FT #SUB 223 244 ASP J 226 247 ASN G Protein S 7 FT #SUB 226 247 ASN J 188 209 LYS G Protein S 1 FT #SUB 226 247 ASN J 223 244 ASP G Protein S 6 FT #SUB 234 255 ARG J 179 200 GLN G Protein S 1 FT #SUB 24 45 PRO J 195 216 LEU K Protein S 2 FT #SUB 24 45 PRO J 200 221 LEU K Protein S 1 FT #SUB 25 46 LEU J 200 221 LEU K Protein S 1 FT #SUB 25 46 LEU J 201 222 SER K Protein S 3 FT #SUB 25 46 LEU J 204 225 LEU K Protein S 1 FT #SUB 26 47 LEU J 25 46 LEU K Protein S 1 FT #SUB 26 47 LEU J 26 47 LEU K Protein S 1 FT #SUB 26 47 LEU J 204 225 LEU K Protein S 1 FT #SUB 30 51 LEU J 24 45 PRO K Protein S 3 FT #SUB 33 54 ARG J 24 45 PRO K Protein S 6 FT #SUB 200 221 LEU J 25 46 LEU K Protein S 1 FT #SUB 204 225 LEU J 205 226 PHE K Protein S 1 FT #HET 84 105 ARG J 13 601 HEM J S 9 FT #HET 97 118 ILE J 13 601 HEM J A 2 FT #HET 98 119 SER J 13 601 HEM J A 2 FT #HET 105 126 TRP J 13 601 HEM J S 6 FT #HET 109 130 ARG J 13 601 HEM J S 4 FT #HET 116 137 PHE J 13 601 HEM J S 2 FT #HET 163 184 ILE J 13 601 HEM J S 1 FT #HET 281 302 PHE J 13 601 HEM J A 2 FT #HET 284 305 ALA J 13 601 HEM J A 7 FT #HET 285 306 GLY J 13 601 HEM J B 2 FT #HET 288 309 THR J 13 601 HEM J S 12 FT #HET 292 313 VAL J 13 601 HEM J S 1 FT #HET 348 369 VAL J 13 601 HEM J S 1 FT #HET 349 370 ALA J 13 601 HEM J S 1 FT #HET 352 373 LEU J 13 601 HEM J S 6 FT #HET 354 375 ARG J 13 601 HEM J S 9 FT #HET 412 433 PRO J 13 601 HEM J B 3 FT #HET 413 434 PHE J 13 601 HEM J A 12 FT #HET 414 435 GLY J 13 601 HEM J B 2 FT #HET 415 436 THR J 13 601 HEM J B 1 FT #HET 418 439 ARG J 13 601 HEM J A 14 FT #HET 419 440 ASN J 13 601 HEM J B 5 FT #HET 420 441 CYS J 13 601 HEM J A 28 FT #HET 421 442 ILE J 13 601 HEM J S 2 FT #HET 422 443 GLY J 13 601 HEM J B 1 FT #HET 425 446 PHE J 13 601 HEM J S 1 FT #HET 426 447 ALA J 13 601 HEM J S 2 FT #HET 430 451 MET J 13 601 HEM J S 1 FT DISORDER 1 5 FT DISORDER 261 267 FT DISORDER 400 403 FT DISORDER 475 480 CC SEQUENCE 458 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNSALSDL ELAAQSIIFI FAGYETTSSV LSFTLYELAT HPDVQQKLQK CC EIDAVLPNKA PPTYDAVVQM EYLDMVVNET LRLFPVAIRL ERTCKKDVEI NGVFIPKGSM CC VVIPTYALHH DPKYWTEPEE FRPERFSSID PYIYTPFGTG PRNCIGMRFA LMNMKLALIR CC VLQNFSFKPC KETQIPLKLD TQGLLQPEKP IVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ---SIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC *********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUK STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 179 200 GLN K 234 255 ARG C Protein S 1 FT #SUB 184 205 GLU K 230 251 LYS C Protein S 1 FT #SUB 184 205 GLU K 234 255 ARG C Protein S 3 FT #SUB 212 233 PHE K 215 236 LEU C Protein S 1 FT #SUB 215 236 LEU K 212 233 PHE C Protein S 3 FT #SUB 215 236 LEU K 215 236 LEU C Protein S 1 FT #SUB 223 244 ASP K 223 244 ASP C Protein A 2 FT #SUB 223 244 ASP K 226 247 ASN C Protein S 3 FT #SUB 226 247 ASN K 223 244 ASP C Protein S 4 FT #SUB 234 255 ARG K 179 200 GLN C Protein S 6 FT #SUB 234 255 ARG K 184 205 GLU C Protein S 5 FT #SUB 110 131 SER K 315 336 ASP F Protein S 1 FT #SUB 110 131 SER K 319 340 PRO F Protein A 5 FT #SUB 111 132 LEU K 319 340 PRO F Protein B 2 FT #SUB 111 132 LEU K 320 341 ASN F Protein S 1 FT #SUB 257 278 SER K 320 341 ASN F Protein S 1 FT #SUB 268 289 ALA K 320 341 ASN F Protein B 3 FT #SUB 207 228 PHE K 211 232 VAL G Protein A 3 FT #SUB 207 228 PHE K 214 235 ALA G Protein S 2 FT #SUB 210 231 PRO K 207 228 PHE G Protein A 5 FT #SUB 211 232 VAL K 207 228 PHE G Protein A 4 FT #SUB 211 232 VAL K 211 232 VAL G Protein S 1 FT #SUB 214 235 ALA K 207 228 PHE G Protein S 2 FT #SUB 24 45 PRO K 30 51 LEU J Protein S 3 FT #SUB 24 45 PRO K 33 54 ARG J Protein S 6 FT #SUB 25 46 LEU K 26 47 LEU J Protein S 1 FT #SUB 25 46 LEU K 200 221 LEU J Protein S 1 FT #SUB 26 47 LEU K 26 47 LEU J Protein S 1 FT #SUB 195 216 LEU K 24 45 PRO J Protein S 2 FT #SUB 200 221 LEU K 24 45 PRO J Protein S 1 FT #SUB 200 221 LEU K 25 46 LEU J Protein S 1 FT #SUB 201 222 SER K 25 46 LEU J Protein A 3 FT #SUB 204 225 LEU K 25 46 LEU J Protein S 1 FT #SUB 204 225 LEU K 26 47 LEU J Protein S 1 FT #SUB 205 226 PHE K 204 225 LEU J Protein S 1 FT #HET 84 105 ARG K 14 601 HEM K S 10 FT #HET 97 118 ILE K 14 601 HEM K A 5 FT #HET 98 119 SER K 14 601 HEM K B 1 FT #HET 105 126 TRP K 14 601 HEM K S 6 FT #HET 109 130 ARG K 14 601 HEM K S 5 FT #HET 163 184 ILE K 14 601 HEM K S 1 FT #HET 281 302 PHE K 14 601 HEM K S 3 FT #HET 284 305 ALA K 14 601 HEM K A 7 FT #HET 288 309 THR K 14 601 HEM K A 7 FT #HET 292 313 VAL K 14 601 HEM K S 1 FT #HET 348 369 VAL K 14 601 HEM K S 1 FT #HET 349 370 ALA K 14 601 HEM K S 1 FT #HET 352 373 LEU K 14 601 HEM K S 6 FT #HET 354 375 ARG K 14 601 HEM K S 9 FT #HET 412 433 PRO K 14 601 HEM K B 6 FT #HET 413 434 PHE K 14 601 HEM K A 14 FT #HET 414 435 GLY K 14 601 HEM K B 2 FT #HET 418 439 ARG K 14 601 HEM K A 10 FT #HET 419 440 ASN K 14 601 HEM K B 2 FT #HET 420 441 CYS K 14 601 HEM K A 25 FT #HET 421 442 ILE K 14 601 HEM K S 2 FT #HET 422 443 GLY K 14 601 HEM K B 1 FT #HET 425 446 PHE K 14 601 HEM K S 1 FT #HET 426 447 ALA K 14 601 HEM K S 2 FT #HET 430 451 MET K 14 601 HEM K S 1 FT DISORDER 1 5 FT DISORDER 260 267 FT DISORDER 400 402 FT DISORDER 475 480 CC SEQUENCE 458 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNDKQK CC HRLDFLQLMI DSQNALSDLE LAAQSIIFIF AGYETTSSVL SFTLYELATH PDVQQKLQKE CC IDAVLPNKAP PTYDAVVQME YLDMVVNETL RLFPVAIRLE RTCKKDVEIN GVFIPKGSMV CC VIPTYALHHD PKYWTEPEEF RPERFSDSID PYIYTPFGTG PRNCIGMRFA LMNMKLALIR CC VLQNFSFKPC KETQIPLKLD TQGLLQPEKP IVLKVDSR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ************************************************** CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQN--------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********* ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM --DSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ************************************************ CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDSR------ CC ************************ SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH // ID 5VEUL STANDARD; PRT; 480 AA. DT CONVERTED FROM PDB (SEQRES) 5VEU DE Cytochrome P450 3A5 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.910 CC R-Factor 0.216 FT #SUB 24 45 PRO L 33 54 ARG B Protein S 2 FT #SUB 24 45 PRO L 195 216 LEU B Protein S 1 FT #SUB 25 46 LEU L 195 216 LEU B Protein S 2 FT #SUB 25 46 LEU L 200 221 LEU B Protein S 1 FT #SUB 26 47 LEU L 30 51 LEU B Protein S 1 FT #SUB 30 51 LEU L 23 44 LEU B Protein S 1 FT #SUB 195 216 LEU L 24 45 PRO B Protein A 5 FT #SUB 200 221 LEU L 25 46 LEU B Protein S 3 FT #SUB 201 222 SER L 25 46 LEU B Protein B 1 FT #SUB 204 225 LEU L 26 47 LEU B Protein S 2 FT #SUB 204 225 LEU L 204 225 LEU B Protein S 1 FT #SUB 205 226 PHE L 200 221 LEU B Protein S 1 FT #SUB 205 226 PHE L 205 226 PHE B Protein S 1 FT #SUB 207 228 PHE L 210 231 PRO F Protein S 1 FT #SUB 207 228 PHE L 211 232 VAL F Protein A 2 FT #SUB 207 228 PHE L 214 235 ALA F Protein S 4 FT #SUB 211 232 VAL L 211 232 VAL F Protein S 1 FT #SUB 214 235 ALA L 207 228 PHE F Protein S 6 FT #SUB 212 233 PHE L 215 236 LEU H Protein S 1 FT #SUB 215 236 LEU L 212 233 PHE H Protein S 1 FT #SUB 215 236 LEU L 215 236 LEU H Protein S 1 FT #SUB 215 236 LEU L 217 238 VAL H Protein B 1 FT #HET 84 105 ARG L 15 601 HEM L S 14 FT #HET 97 118 ILE L 15 601 HEM L A 4 FT #HET 98 119 SER L 15 601 HEM L A 4 FT #HET 105 126 TRP L 15 601 HEM L S 6 FT #HET 109 130 ARG L 15 601 HEM L S 5 FT #HET 116 137 PHE L 15 601 HEM L S 2 FT #HET 163 184 ILE L 15 601 HEM L S 1 FT #HET 281 302 PHE L 15 601 HEM L S 7 FT #HET 284 305 ALA L 15 601 HEM L A 7 FT #HET 285 306 GLY L 15 601 HEM L B 2 FT #HET 288 309 THR L 15 601 HEM L A 10 FT #HET 292 313 VAL L 15 601 HEM L S 1 FT #HET 348 369 VAL L 15 601 HEM L S 1 FT #HET 349 370 ALA L 15 601 HEM L S 1 FT #HET 352 373 LEU L 15 601 HEM L S 3 FT #HET 354 375 ARG L 15 601 HEM L S 9 FT #HET 412 433 PRO L 15 601 HEM L B 3 FT #HET 413 434 PHE L 15 601 HEM L A 14 FT #HET 414 435 GLY L 15 601 HEM L B 1 FT #HET 418 439 ARG L 15 601 HEM L A 9 FT #HET 419 440 ASN L 15 601 HEM L B 5 FT #HET 420 441 CYS L 15 601 HEM L A 22 FT #HET 421 442 ILE L 15 601 HEM L S 1 FT #HET 425 446 PHE L 15 601 HEM L S 1 FT #HET 426 447 ALA L 15 601 HEM L S 2 FT #HET 430 451 MET L 15 601 HEM L S 1 FT DISORDER 1 5 FT DISORDER 242 249 FT DISORDER 261 267 FT DISORDER 400 404 FT DISORDER 474 480 CC SEQUENCE 448 AA (ATOM); CC TRTHGLFKRL GIPGPTPLPL LGNVLSYRQG LWKFDTECYK KYGKMWGTYE GQLPVLAITD CC PDVIRTVLVK ECYSVFTNRR SLGPVGFMKS AISLAEDEEW KRIRSLLSPT FTSGKLKEMF CC PIIAQYGDVL VRNLRREAEK GKPVTLKDIF GAYSMDVITG TSFGVNIDSL NNPQDPFVES CC TKKFLKFGFL DPLFLSIILF PFLTPVFEAL NVSLFPKDTI NFLSKSVNRM KKSRLNFLQL CC MIDSQNSALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN CC KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL CC HHDPKYWTEP EEFRPERFSI DPYIYTPFGT GPRNCIGMRF ALMNMKLALI RVLQNFSFKP CC CKETQIPLKL DTQGLLQPEK PIVLKVDS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MALYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ATOM -----TRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKM CC ********************************************* CC SEQRES WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ATOM WGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLA CC ************************************************** CC SEQRES EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ATOM EDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVT CC ************************************************** CC SEQRES LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ATOM LKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFL CC ************************************************** CC SEQRES SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDF CC ATOM SIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLN--------F CC ***************************************** * CC SEQRES LQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ATOM LQLMIDSQNS-------ALSDLELAAQSIIFIFAGYETTSSVLSFTLYEL CC ********** ********************************* CC SEQRES ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ATOM ATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAI CC ************************************************** CC SEQRES RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSK CC ATOM RLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFS- CC ************************************************* CC SEQRES KKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ATOM ----IDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQ CC ********************************************** CC SEQRES IPLKLDTQGLLQPEKPIVLKVDSRDGHHHH CC ATOM IPLKLDTQGLLQPEKPIVLKVDS------- CC *********************** SQ SEQUENCE 480 AA; MW; CN; MALYGTRTHG LFKRLGIPGP TPLPLLGNVL SYRQGLWKFD TECYKKYGKM WGTYEGQLPV LAITDPDVIR TVLVKECYSV FTNRRSLGPV GFMKSAISLA EDEEWKRIRS LLSPTFTSGK LKEMFPIIAQ YGDVLVRNLR REAEKGKPVT LKDIFGAYSM DVITGTSFGV NIDSLNNPQD PFVESTKKFL KFGFLDPLFL SIILFPFLTP VFEALNVSLF PKDTINFLSK SVNRMKKSRL NDKQKHRLDF LQLMIDSQNS KETESHKALS DLELAAQSII FIFAGYETTS SVLSFTLYEL ATHPDVQQKL QKEIDAVLPN KAPPTYDAVV QMEYLDMVVN ETLRLFPVAI RLERTCKKDV EINGVFIPKG SMVVIPTYAL HHDPKYWTEP EEFRPERFSK KKDSIDPYIY TPFGTGPRNC IGMRFALMNM KLALIRVLQN FSFKPCKETQ IPLKLDTQGL LQPEKPIVLK VDSRDGHHHH //