ID 2AMQA STANDARD; PRT; 311 AA. DT CONVERTED FROM PDB (SEQRES) 2AMQ DE 3C-like proteinase OS SARS coronavirus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.216 FT #SUB 9 4 ARG A 10 5 LYS B Protein S 1 FT #SUB 9 4 ARG A 131 126 TYR B Protein S 3 FT #SUB 9 4 ARG A 132 127 GLN B Protein S 1 FT #SUB 9 4 ARG A 133 128 CYS B Protein S 2 FT #SUB 9 4 ARG A 142 137 LYS B Protein S 5 FT #SUB 9 4 ARG A 143 138 GLY B Protein S 2 FT #SUB 9 4 ARG A 144 139 SER B Protein S 1 FT #SUB 9 4 ARG A 295 290 GLU B Protein S 6 FT #SUB 10 5 LYS A 9 4 ARG B Protein S 4 FT #SUB 11 6 MET A 130 125 VAL B Protein B 2 FT #SUB 11 6 MET A 131 126 TYR B Protein S 1 FT #SUB 12 7 ALA A 129 124 GLY B Protein B 2 FT #SUB 12 7 ALA A 130 125 VAL B Protein A 9 FT #SUB 13 8 PHE A 130 125 VAL B Protein B 1 FT #SUB 14 9 PRO A 15 10 SER B Protein B 2 FT #SUB 14 9 PRO A 19 14 GLU B Protein A 5 FT #SUB 14 9 PRO A 127 122 PRO B Protein S 4 FT #SUB 14 9 PRO A 128 123 SER B Protein S 4 FT #SUB 14 9 PRO A 129 124 GLY B Protein S 1 FT #SUB 15 10 SER A 14 9 PRO B Protein S 3 FT #SUB 15 10 SER A 15 10 SER B Protein A 3 FT #SUB 15 10 SER A 19 14 GLU B Protein B 3 FT #SUB 16 11 GLY A 16 11 GLY B Protein B 4 FT #SUB 16 11 GLY A 19 14 GLU B Protein B 6 FT #SUB 19 14 GLU A 14 9 PRO B Protein S 5 FT #SUB 19 14 GLU A 15 10 SER B Protein S 3 FT #SUB 19 14 GLU A 16 11 GLY B Protein S 6 FT #SUB 120 115 LEU A 14 9 PRO B Protein S 1 FT #SUB 127 122 PRO A 14 9 PRO B Protein A 4 FT #SUB 128 123 SER A 14 9 PRO B Protein B 4 FT #SUB 128 123 SER A 303 298 ARG B Protein A 2 FT #SUB 129 124 GLY A 12 7 ALA B Protein B 2 FT #SUB 129 124 GLY A 14 9 PRO B Protein B 3 FT #SUB 130 125 VAL A 11 6 MET B Protein B 3 FT #SUB 130 125 VAL A 12 7 ALA B Protein A 5 FT #SUB 130 125 VAL A 13 8 PHE B Protein S 1 FT #SUB 130 125 VAL A 130 125 VAL B Protein S 1 FT #SUB 131 126 TYR A 9 4 ARG B Protein S 5 FT #SUB 131 126 TYR A 11 6 MET B Protein S 4 FT #SUB 132 127 GLN A 9 4 ARG B Protein B 3 FT #SUB 142 137 LYS A 9 4 ARG B Protein A 5 FT #SUB 143 138 GLY A 6 1 SER B Protein B 1 FT #SUB 143 138 GLY A 7 2 GLY B Protein B 2 FT #SUB 143 138 GLY A 8 3 PHE B Protein B 1 FT #SUB 144 139 SER A 6 1 SER B Protein A 3 FT #SUB 144 139 SER A 7 2 GLY B Protein S 1 FT #SUB 144 139 SER A 9 4 ARG B Protein S 2 FT #SUB 144 139 SER A 11 6 MET B Protein S 2 FT #SUB 144 139 SER A 304 299 GLN B Protein S 4 FT #SUB 145 140 PHE A 6 1 SER B Protein B 5 FT #SUB 146 141 LEU A 6 1 SER B Protein S 2 FT #SUB 146 141 LEU A 304 299 GLN B Protein S 3 FT #SUB 146 141 LEU A 305 300 CYS B Protein S 1 FT #SUB 146 141 LEU A 306 301 SER B Protein S 1 FT #SUB 171 166 GLU A 6 1 SER B Protein S 2 FT #SUB 177 172 HIS A 6 1 SER B Protein S 2 FT #SUB 290 285 THR A 290 285 THR B Protein S 1 FT #SUB 290 285 THR A 291 286 ILE B Protein S 1 FT #SUB 291 286 ILE A 290 285 THR B Protein S 2 FT #SUB 295 290 GLU A 9 4 ARG B Protein S 5 FT #SUB 304 299 GLN A 144 139 SER B Protein S 3 FT #SUB 304 299 GLN A 146 141 LEU B Protein B 1 FT #SUB 305 300 CYS A 146 141 LEU B Protein B 1 FT #SUB 307 302 GLY A 123 118 TYR B Protein B 1 FT #SUB 307 302 GLY A 146 141 LEU B Protein B 2 FT #SUB 308 303 VAL A 128 123 SER B Protein B 4 FT #SUB 309 304 THR A 123 118 TYR B Protein S 2 FT #SUB 309 304 THR A 126 121 SER B Protein S 3 FT #SUB 309 304 THR A 127 122 PRO B Protein A 3 FT #SUB 310 305 PHE A 127 122 PRO B Protein A 3 FT #SUB 310 305 PHE A 128 123 SER B Protein S 2 FT #SUB 30 25 THR A 6 6 010 C Protein S 4 FT #SUB 31 26 THR A 6 6 010 C Protein B 1 FT #SUB 32 27 LEU A 5 5 PJE C Protein S 1 FT #SUB 46 41 HIS A 4 4 LEU C Protein S 4 FT #SUB 46 41 HIS A 5 5 PJE C Protein S 2 FT #SUB 54 49 MET A 4 4 LEU C Protein S 2 FT #SUB 54 49 MET A 6 6 010 C Protein S 2 FT #SUB 59 54 TYR A 4 4 LEU C Protein S 1 FT #SUB 145 140 PHE A 5 5 PJE C Protein A 3 FT #SUB 146 141 LEU A 5 5 PJE C Protein B 2 FT #SUB 147 142 ASN A 5 5 PJE C Protein S 1 FT #SUB 148 143 GLY A 5 5 PJE C Protein B 6 FT #SUB 148 143 GLY A 6 6 010 C Protein B 1 FT #SUB 149 144 SER A 5 5 PJE C Protein B 1 FT #SUB 150 145 CYS A 5 5 PJE C Protein A 15 FT #SUB 168 163 HIS A 5 5 PJE C Protein S 4 FT #SUB 169 164 HIS A 4 4 LEU C Protein B 2 FT #SUB 169 164 HIS A 5 5 PJE C Protein B 4 FT #SUB 170 165 MET A 2 2 ALA C Protein S 1 FT #SUB 170 165 MET A 3 3 VAL C Protein A 4 FT #SUB 170 165 MET A 4 4 LEU C Protein S 2 FT #SUB 170 165 MET A 5 5 PJE C Protein B 3 FT #SUB 171 166 GLU A 2 2 ALA C Protein B 1 FT #SUB 171 166 GLU A 3 3 VAL C Protein B 6 FT #SUB 171 166 GLU A 5 5 PJE C Protein A 8 FT #SUB 173 168 PRO A 1 1 02J C Protein S 7 FT #SUB 173 168 PRO A 2 2 ALA C Protein S 1 FT #SUB 177 172 HIS A 5 5 PJE C Protein S 1 FT #SUB 192 187 ASP A 4 4 LEU C Protein B 3 FT #SUB 193 188 ARG A 2 2 ALA C Protein B 1 FT #SUB 193 188 ARG A 4 4 LEU C Protein B 1 FT #SUB 194 189 GLN A 2 2 ALA C Protein A 5 FT #SUB 194 189 GLN A 3 3 VAL C Protein S 3 FT #SUB 194 189 GLN A 4 4 LEU C Protein S 6 FT #SUB 195 190 THR A 1 1 02J C Protein B 2 FT #SUB 195 190 THR A 2 2 ALA C Protein B 4 FT #SUB 196 191 ALA A 1 1 02J C Protein B 1 FT #SUB 197 192 GLN A 1 1 02J C Protein B 2 FT #SUB 197 192 GLN A 2 2 ALA C Protein S 1 FT DISORDER 1 7 FT DISORDER 311 311 CC SEQUENCE 303 AA (ATOM); CC FRKMAFPSGK VEGCMVQVTC GTTTLNGLWL DDTVYCPRHV ICTAEDMLNP NYEDLLIRKS CC NHSFLVQAGN VQLRVIGHSM QNCLLRLKVD TSNPKTPKYK FVRIQPGQTF SVLACYNGSP CC SGVYQCAMRP NHTIKGSFLN GSCGSVGFNI DYDCVSFCYM HHMELPTGVH AGTDLEGKFY CC GPFVDRQTAQ AAGTDTTITL NVLAWLYAAV INGDRWFLNR FTTTLNDFNL VAMKYNYEPL CC TQDHVDILGP LSAQTGIAVL DMCAALKELL QNGMNGRTIL GSTILEDEFT PFDVVRQCSG CC VTF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GPLGSSGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICT CC ATOM -------FRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICT CC ******************************************* CC SEQRES AEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSN CC ATOM AEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSN CC ************************************************** CC SEQRES PKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSC CC ATOM PKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSC CC ************************************************** CC SEQRES GSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDRQTAQAAG CC ATOM GSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDRQTAQAAG CC ************************************************** CC SEQRES TDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQD CC ATOM TDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQD CC ************************************************** CC SEQRES HVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFD CC ATOM HVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFD CC ************************************************** CC SEQRES VVRQCSGVTFQ CC ATOM VVRQCSGVTF- CC ********** SQ SEQUENCE 311 AA; MW; CN; GPLGSSGFRK MAFPSGKVEG CMVQVTCGTT TLNGLWLDDT VYCPRHVICT AEDMLNPNYE DLLIRKSNHS FLVQAGNVQL RVIGHSMQNC LLRLKVDTSN PKTPKYKFVR IQPGQTFSVL ACYNGSPSGV YQCAMRPNHT IKGSFLNGSC GSVGFNIDYD CVSFCYMHHM ELPTGVHAGT DLEGKFYGPF VDRQTAQAAG TDTTITLNVL AWLYAAVING DRWFLNRFTT TLNDFNLVAM KYNYEPLTQD HVDILGPLSA QTGIAVLDMC AALKELLQNG MNGRTILGST ILEDEFTPFD VVRQCSGVTF Q // ID 2AMQB STANDARD; PRT; 311 AA. DT CONVERTED FROM PDB (SEQRES) 2AMQ DE 3C-like proteinase OS SARS coronavirus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.216 FT #SUB 6 1 SER B 143 138 GLY A Protein B 1 FT #SUB 6 1 SER B 144 139 SER A Protein B 3 FT #SUB 6 1 SER B 145 140 PHE A Protein A 5 FT #SUB 6 1 SER B 146 141 LEU A Protein S 2 FT #SUB 6 1 SER B 171 166 GLU A Protein B 2 FT #SUB 6 1 SER B 177 172 HIS A Protein B 2 FT #SUB 7 2 GLY B 143 138 GLY A Protein B 2 FT #SUB 7 2 GLY B 144 139 SER A Protein B 1 FT #SUB 8 3 PHE B 143 138 GLY A Protein B 1 FT #SUB 9 4 ARG B 10 5 LYS A Protein S 4 FT #SUB 9 4 ARG B 131 126 TYR A Protein S 5 FT #SUB 9 4 ARG B 132 127 GLN A Protein S 3 FT #SUB 9 4 ARG B 142 137 LYS A Protein S 5 FT #SUB 9 4 ARG B 144 139 SER A Protein A 2 FT #SUB 9 4 ARG B 295 290 GLU A Protein S 5 FT #SUB 10 5 LYS B 9 4 ARG A Protein S 1 FT #SUB 11 6 MET B 130 125 VAL A Protein A 3 FT #SUB 11 6 MET B 131 126 TYR A Protein S 4 FT #SUB 11 6 MET B 144 139 SER A Protein S 2 FT #SUB 12 7 ALA B 129 124 GLY A Protein B 2 FT #SUB 12 7 ALA B 130 125 VAL A Protein B 5 FT #SUB 13 8 PHE B 130 125 VAL A Protein B 1 FT #SUB 14 9 PRO B 15 10 SER A Protein A 3 FT #SUB 14 9 PRO B 19 14 GLU A Protein A 5 FT #SUB 14 9 PRO B 120 115 LEU A Protein S 1 FT #SUB 14 9 PRO B 127 122 PRO A Protein S 4 FT #SUB 14 9 PRO B 128 123 SER A Protein S 4 FT #SUB 14 9 PRO B 129 124 GLY A Protein S 3 FT #SUB 15 10 SER B 14 9 PRO A Protein S 2 FT #SUB 15 10 SER B 15 10 SER A Protein A 3 FT #SUB 15 10 SER B 19 14 GLU A Protein B 3 FT #SUB 16 11 GLY B 16 11 GLY A Protein B 4 FT #SUB 16 11 GLY B 19 14 GLU A Protein B 6 FT #SUB 19 14 GLU B 14 9 PRO A Protein S 5 FT #SUB 19 14 GLU B 15 10 SER A Protein S 3 FT #SUB 19 14 GLU B 16 11 GLY A Protein S 6 FT #SUB 123 118 TYR B 307 302 GLY A Protein S 1 FT #SUB 123 118 TYR B 309 304 THR A Protein A 2 FT #SUB 126 121 SER B 309 304 THR A Protein A 3 FT #SUB 127 122 PRO B 14 9 PRO A Protein A 4 FT #SUB 127 122 PRO B 309 304 THR A Protein B 3 FT #SUB 127 122 PRO B 310 305 PHE A Protein B 3 FT #SUB 128 123 SER B 14 9 PRO A Protein B 4 FT #SUB 128 123 SER B 308 303 VAL A Protein A 4 FT #SUB 128 123 SER B 310 305 PHE A Protein B 2 FT #SUB 129 124 GLY B 12 7 ALA A Protein B 2 FT #SUB 129 124 GLY B 14 9 PRO A Protein B 1 FT #SUB 130 125 VAL B 11 6 MET A Protein B 2 FT #SUB 130 125 VAL B 12 7 ALA A Protein A 9 FT #SUB 130 125 VAL B 13 8 PHE A Protein S 1 FT #SUB 130 125 VAL B 130 125 VAL A Protein S 1 FT #SUB 131 126 TYR B 9 4 ARG A Protein S 3 FT #SUB 131 126 TYR B 11 6 MET A Protein S 1 FT #SUB 132 127 GLN B 9 4 ARG A Protein B 1 FT #SUB 133 128 CYS B 9 4 ARG A Protein S 2 FT #SUB 142 137 LYS B 9 4 ARG A Protein B 5 FT #SUB 143 138 GLY B 9 4 ARG A Protein B 2 FT #SUB 144 139 SER B 9 4 ARG A Protein S 1 FT #SUB 144 139 SER B 304 299 GLN A Protein S 3 FT #SUB 146 141 LEU B 304 299 GLN A Protein S 1 FT #SUB 146 141 LEU B 305 300 CYS A Protein S 1 FT #SUB 146 141 LEU B 307 302 GLY A Protein S 2 FT #SUB 290 285 THR B 290 285 THR A Protein S 1 FT #SUB 290 285 THR B 291 286 ILE A Protein S 2 FT #SUB 291 286 ILE B 290 285 THR A Protein S 1 FT #SUB 295 290 GLU B 9 4 ARG A Protein S 6 FT #SUB 303 298 ARG B 128 123 SER A Protein S 2 FT #SUB 304 299 GLN B 144 139 SER A Protein S 4 FT #SUB 304 299 GLN B 146 141 LEU A Protein B 3 FT #SUB 305 300 CYS B 146 141 LEU A Protein B 1 FT #SUB 306 301 SER B 146 141 LEU A Protein B 1 FT #SUB 29 24 THR B 6 6 010 D Protein B 2 FT #SUB 30 25 THR B 6 6 010 D Protein A 7 FT #SUB 31 26 THR B 6 6 010 D Protein B 5 FT #SUB 32 27 LEU B 5 5 PJE D Protein S 1 FT #SUB 46 41 HIS B 4 4 LEU D Protein S 2 FT #SUB 46 41 HIS B 5 5 PJE D Protein S 2 FT #SUB 54 49 MET B 4 4 LEU D Protein S 2 FT #SUB 145 140 PHE B 5 5 PJE D Protein A 2 FT #SUB 148 143 GLY B 5 5 PJE D Protein B 6 FT #SUB 148 143 GLY B 6 6 010 D Protein B 3 FT #SUB 149 144 SER B 5 5 PJE D Protein A 3 FT #SUB 150 145 CYS B 5 5 PJE D Protein A 15 FT #SUB 168 163 HIS B 5 5 PJE D Protein S 4 FT #SUB 169 164 HIS B 4 4 LEU D Protein B 2 FT #SUB 169 164 HIS B 5 5 PJE D Protein B 4 FT #SUB 170 165 MET B 3 3 VAL D Protein A 4 FT #SUB 170 165 MET B 4 4 LEU D Protein S 2 FT #SUB 170 165 MET B 5 5 PJE D Protein B 2 FT #SUB 171 166 GLU B 2 2 ALA D Protein B 2 FT #SUB 171 166 GLU B 3 3 VAL D Protein B 5 FT #SUB 171 166 GLU B 5 5 PJE D Protein A 4 FT #SUB 173 168 PRO B 1 1 02J D Protein A 9 FT #SUB 173 168 PRO B 2 2 ALA D Protein S 2 FT #SUB 177 172 HIS B 5 5 PJE D Protein S 2 FT #SUB 192 187 ASP B 4 4 LEU D Protein B 2 FT #SUB 193 188 ARG B 4 4 LEU D Protein B 1 FT #SUB 194 189 GLN B 2 2 ALA D Protein A 6 FT #SUB 194 189 GLN B 3 3 VAL D Protein S 3 FT #SUB 194 189 GLN B 4 4 LEU D Protein S 4 FT #SUB 195 190 THR B 2 2 ALA D Protein B 4 FT #SUB 197 192 GLN B 2 2 ALA D Protein S 1 FT DISORDER 1 5 FT DISORDER 308 311 CC SEQUENCE 302 AA (ATOM); CC SGFRKMAFPS GKVEGCMVQV TCGTTTLNGL WLDDTVYCPR HVICTAEDML NPNYEDLLIR CC KSNHSFLVQA GNVQLRVIGH SMQNCLLRLK VDTSNPKTPK YKFVRIQPGQ TFSVLACYNG CC SPSGVYQCAM RPNHTIKGSF LNGSCGSVGF NIDYDCVSFC YMHHMELPTG VHAGTDLEGK CC FYGPFVDRQT AQAAGTDTTI TLNVLAWLYA AVINGDRWFL NRFTTTLNDF NLVAMKYNYE CC PLTQDHVDIL GPLSAQTGIA VLDMCAALKE LLQNGMNGRT ILGSTILEDE FTPFDVVRQC CC SG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GPLGSSGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICT CC ATOM -----SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICT CC ********************************************* CC SEQRES AEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSN CC ATOM AEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSN CC ************************************************** CC SEQRES PKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSC CC ATOM PKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSC CC ************************************************** CC SEQRES GSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDRQTAQAAG CC ATOM GSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDRQTAQAAG CC ************************************************** CC SEQRES TDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQD CC ATOM TDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQD CC ************************************************** CC SEQRES HVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFD CC ATOM HVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFD CC ************************************************** CC SEQRES VVRQCSGVTFQ CC ATOM VVRQCSG---- CC ******* SQ SEQUENCE 311 AA; MW; CN; GPLGSSGFRK MAFPSGKVEG CMVQVTCGTT TLNGLWLDDT VYCPRHVICT AEDMLNPNYE DLLIRKSNHS FLVQAGNVQL RVIGHSMQNC LLRLKVDTSN PKTPKYKFVR IQPGQTFSVL ACYNGSPSGV YQCAMRPNHT IKGSFLNGSC GSVGFNIDYD CVSFCYMHHM ELPTGVHAGT DLEGKFYGPF VDRQTAQAAG TDTTITLNVL AWLYAAVING DRWFLNRFTT TLNDFNLVAM KYNYEPLTQD HVDILGPLSA QTGIAVLDMC AALKELLQNG MNGRTILGST ILEDEFTPFD VVRQCSGVTF Q // ID 2AMQC STANDARD; PRT; 6 AA. DT CONVERTED FROM PDB (SEQRES) 2AMQ DE N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOX DE Y)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.216 FT #SUB 1 1 02J C 173 168 PRO A Protein A 7 FT #SUB 1 1 02J C 195 190 THR A Protein B 2 FT #SUB 1 1 02J C 196 191 ALA A Protein B 1 FT #SUB 1 1 02J C 197 192 GLN A Protein B 2 FT #SUB 2 2 ALA C 170 165 MET A Protein S 1 FT #SUB 2 2 ALA C 171 166 GLU A Protein B 1 FT #SUB 2 2 ALA C 173 168 PRO A Protein B 1 FT #SUB 2 2 ALA C 193 188 ARG A Protein S 1 FT #SUB 2 2 ALA C 194 189 GLN A Protein B 5 FT #SUB 2 2 ALA C 195 190 THR A Protein A 4 FT #SUB 2 2 ALA C 197 192 GLN A Protein S 1 FT #SUB 3 3 VAL C 170 165 MET A Protein B 4 FT #SUB 3 3 VAL C 171 166 GLU A Protein A 6 FT #SUB 3 3 VAL C 194 189 GLN A Protein A 3 FT #SUB 4 4 LEU C 46 41 HIS A Protein S 4 FT #SUB 4 4 LEU C 54 49 MET A Protein S 2 FT #SUB 4 4 LEU C 59 54 TYR A Protein S 1 FT #SUB 4 4 LEU C 169 164 HIS A Protein B 2 FT #SUB 4 4 LEU C 170 165 MET A Protein S 2 FT #SUB 4 4 LEU C 192 187 ASP A Protein S 3 FT #SUB 4 4 LEU C 193 188 ARG A Protein S 1 FT #SUB 4 4 LEU C 194 189 GLN A Protein A 6 FT #SUB 5 5 PJE C 32 27 LEU A Protein B 1 FT #SUB 5 5 PJE C 46 41 HIS A Protein S 2 FT #SUB 5 5 PJE C 145 140 PHE A Protein S 3 FT #SUB 5 5 PJE C 146 141 LEU A Protein S 2 FT #SUB 5 5 PJE C 147 142 ASN A Protein S 1 FT #SUB 5 5 PJE C 148 143 GLY A Protein B 6 FT #SUB 5 5 PJE C 149 144 SER A Protein B 1 FT #SUB 5 5 PJE C 150 145 CYS A Protein A 15 FT #SUB 5 5 PJE C 168 163 HIS A Protein S 4 FT #SUB 5 5 PJE C 169 164 HIS A Protein A 4 FT #SUB 5 5 PJE C 170 165 MET A Protein A 3 FT #SUB 5 5 PJE C 171 166 GLU A Protein S 8 FT #SUB 5 5 PJE C 177 172 HIS A Protein S 1 FT #SUB 6 6 010 C 30 25 THR A Protein S 4 FT #SUB 6 6 010 C 31 26 THR A Protein B 1 FT #SUB 6 6 010 C 54 49 MET A Protein S 2 FT #SUB 6 6 010 C 148 143 GLY A Protein B 1 CC SEQUENCE 6 AA (ATOM); CC XAVLXX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XAVLXX CC ATOM XAVLXX CC ****** SQ SEQUENCE 6 AA; MW; CN; XAVLXX // ID 2AMQD STANDARD; PRT; 6 AA. DT CONVERTED FROM PDB (SEQRES) 2AMQ DE N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOX DE Y)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE OS syntetic CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.300 CC R-Factor 0.216 FT #SUB 1 1 02J D 173 168 PRO B Protein A 9 FT #SUB 2 2 ALA D 171 166 GLU B Protein B 2 FT #SUB 2 2 ALA D 173 168 PRO B Protein B 2 FT #SUB 2 2 ALA D 194 189 GLN B Protein B 6 FT #SUB 2 2 ALA D 195 190 THR B Protein A 4 FT #SUB 2 2 ALA D 197 192 GLN B Protein S 1 FT #SUB 3 3 VAL D 170 165 MET B Protein B 4 FT #SUB 3 3 VAL D 171 166 GLU B Protein B 5 FT #SUB 3 3 VAL D 194 189 GLN B Protein A 3 FT #SUB 4 4 LEU D 46 41 HIS B Protein S 2 FT #SUB 4 4 LEU D 54 49 MET B Protein S 2 FT #SUB 4 4 LEU D 169 164 HIS B Protein B 2 FT #SUB 4 4 LEU D 170 165 MET B Protein A 2 FT #SUB 4 4 LEU D 192 187 ASP B Protein S 2 FT #SUB 4 4 LEU D 193 188 ARG B Protein S 1 FT #SUB 4 4 LEU D 194 189 GLN B Protein A 4 FT #SUB 5 5 PJE D 32 27 LEU B Protein B 1 FT #SUB 5 5 PJE D 46 41 HIS B Protein S 2 FT #SUB 5 5 PJE D 145 140 PHE B Protein S 2 FT #SUB 5 5 PJE D 148 143 GLY B Protein B 6 FT #SUB 5 5 PJE D 149 144 SER B Protein A 3 FT #SUB 5 5 PJE D 150 145 CYS B Protein A 15 FT #SUB 5 5 PJE D 168 163 HIS B Protein S 4 FT #SUB 5 5 PJE D 169 164 HIS B Protein A 4 FT #SUB 5 5 PJE D 170 165 MET B Protein A 2 FT #SUB 5 5 PJE D 171 166 GLU B Protein S 4 FT #SUB 5 5 PJE D 177 172 HIS B Protein S 2 FT #SUB 6 6 010 D 29 24 THR B Protein S 2 FT #SUB 6 6 010 D 30 25 THR B Protein S 7 FT #SUB 6 6 010 D 31 26 THR B Protein A 5 FT #SUB 6 6 010 D 148 143 GLY B Protein B 3 CC SEQUENCE 6 AA (ATOM); CC XAVLXX CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES XAVLXX CC ATOM XAVLXX CC ****** SQ SEQUENCE 6 AA; MW; CN; XAVLXX //