ID 1AE1A STANDARD; PRT; 273 AA. DT CONVERTED FROM PDB (SEQRES) 1AE1 DE TROPINONE REDUCTASE-I OS Datura stramonium CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.155 FT #SUB 82 82 ARG A 120 120 GLU B Protein S 4 FT #SUB 114 114 GLU A 188 188 GLU B Protein B 2 FT #SUB 115 115 ALA A 135 135 TYR B Protein B 5 FT #SUB 115 115 ALA A 139 139 GLN B Protein B 3 FT #SUB 115 115 ALA A 185 185 LEU B Protein S 1 FT #SUB 115 115 ALA A 188 188 GLU B Protein A 7 FT #SUB 116 116 LYS A 139 139 GLN B Protein B 2 FT #SUB 116 116 LYS A 142 142 TYR B Protein S 3 FT #SUB 118 118 PHE A 135 135 TYR B Protein S 3 FT #SUB 118 118 PHE A 139 139 GLN B Protein B 5 FT #SUB 120 120 GLU A 82 82 ARG B Protein S 6 FT #SUB 123 123 TYR A 127 127 MET B Protein S 1 FT #SUB 123 123 TYR A 131 131 PHE B Protein S 3 FT #SUB 123 123 TYR A 132 132 GLU B Protein S 10 FT #SUB 127 127 MET A 127 127 MET B Protein S 1 FT #SUB 127 127 MET A 131 131 PHE B Protein S 1 FT #SUB 131 131 PHE A 123 123 TYR B Protein S 3 FT #SUB 131 131 PHE A 170 170 LEU B Protein S 2 FT #SUB 131 131 PHE A 173 173 ALA B Protein S 2 FT #SUB 132 132 GLU A 123 123 TYR B Protein S 11 FT #SUB 135 135 TYR A 115 115 ALA B Protein S 5 FT #SUB 135 135 TYR A 118 118 PHE B Protein S 3 FT #SUB 135 135 TYR A 169 169 SER B Protein S 1 FT #SUB 135 135 TYR A 170 170 LEU B Protein S 1 FT #SUB 139 139 GLN A 115 115 ALA B Protein S 3 FT #SUB 139 139 GLN A 116 116 LYS B Protein S 3 FT #SUB 139 139 GLN A 118 118 PHE B Protein S 5 FT #SUB 142 142 TYR A 116 116 LYS B Protein S 3 FT #SUB 160 160 ALA A 180 180 GLN B Protein B 2 FT #SUB 161 161 GLY A 180 180 GLN B Protein B 3 FT #SUB 162 162 PHE A 180 180 GLN B Protein B 2 FT #SUB 162 162 PHE A 183 183 LYS B Protein B 2 FT #SUB 163 163 SER A 180 180 GLN B Protein B 3 FT #SUB 164 164 ALA A 183 183 LYS B Protein S 2 FT #SUB 164 164 ALA A 184 184 SER B Protein S 2 FT #SUB 164 164 ALA A 187 187 CYS B Protein S 1 FT #SUB 169 169 SER A 181 181 MET B Protein B 2 FT #SUB 169 169 SER A 184 184 SER B Protein A 3 FT #SUB 169 169 SER A 188 188 GLU B Protein S 1 FT #SUB 172 172 SER A 180 180 GLN B Protein A 4 FT #SUB 173 173 ALA A 131 131 PHE B Protein S 1 FT #SUB 173 173 ALA A 177 177 ALA B Protein A 3 FT #SUB 173 173 ALA A 181 181 MET B Protein S 1 FT #SUB 176 176 GLY A 176 176 GLY B Protein B 4 FT #SUB 177 177 ALA A 173 173 ALA B Protein A 4 FT #SUB 177 177 ALA A 177 177 ALA B Protein B 1 FT #SUB 180 180 GLN A 160 160 ALA B Protein S 1 FT #SUB 180 180 GLN A 161 161 GLY B Protein S 2 FT #SUB 180 180 GLN A 162 162 PHE B Protein S 4 FT #SUB 180 180 GLN A 172 172 SER B Protein S 3 FT #SUB 180 180 GLN A 173 173 ALA B Protein S 1 FT #SUB 180 180 GLN A 176 176 GLY B Protein S 1 FT #SUB 181 181 MET A 169 169 SER B Protein S 2 FT #SUB 181 181 MET A 170 170 LEU B Protein S 2 FT #SUB 181 181 MET A 173 173 ALA B Protein S 1 FT #SUB 183 183 LYS A 162 162 PHE B Protein S 3 FT #SUB 183 183 LYS A 164 164 ALA B Protein B 2 FT #SUB 184 184 SER A 164 164 ALA B Protein A 3 FT #SUB 184 184 SER A 169 169 SER B Protein S 4 FT #SUB 185 185 LEU A 115 115 ALA B Protein S 1 FT #SUB 187 187 CYS A 164 164 ALA B Protein S 1 FT #SUB 188 188 GLU A 114 114 GLU B Protein S 3 FT #SUB 188 188 GLU A 115 115 ALA B Protein S 7 FT #SUB 188 188 GLU A 169 169 SER B Protein S 1 FT #HET 28 28 GLY A 1 274 NAP A B 9 FT #HET 30 30 SER A 1 274 NAP A A 5 FT #HET 31 31 LYS A 1 274 NAP A A 6 FT #HET 32 32 GLY A 1 274 NAP A B 2 FT #HET 33 33 ILE A 1 274 NAP A A 5 FT #HET 52 52 SER A 1 274 NAP A A 4 FT #HET 53 53 ARG A 1 274 NAP A A 35 FT #HET 54 54 ASN A 1 274 NAP A S 1 FT #HET 57 57 GLU A 1 274 NAP A S 1 FT #HET 77 77 CYS A 1 274 NAP A B 2 FT #HET 78 78 ASP A 1 274 NAP A A 4 FT #HET 79 79 LEU A 1 274 NAP A A 13 FT #HET 106 106 ASN A 1 274 NAP A A 9 FT #HET 107 107 ALA A 1 274 NAP A A 5 FT #HET 108 108 GLY A 1 274 NAP A B 4 FT #HET 156 156 LEU A 1 274 NAP A S 6 FT #HET 157 157 SER A 1 274 NAP A B 4 FT #HET 158 158 SER A 1 274 NAP A A 5 FT #HET 171 171 TYR A 1 274 NAP A S 7 FT #HET 175 175 LYS A 1 274 NAP A S 4 FT #HET 201 201 PRO A 1 274 NAP A A 2 FT #HET 202 202 GLY A 1 274 NAP A B 2 FT #HET 203 203 VAL A 1 274 NAP A B 2 FT #HET 204 204 ILE A 1 274 NAP A A 8 FT DISORDER 1 15 FT DISORDER 206 218 CC SEQUENCE 245 AA (ATOM); CC RWSLKGTTAL VTGGSKGIGY AIVEELAGLG ARVYTCSRNE KELDECLEIW REKGLNVEGS CC VCDLLSRTER DKLMQTVAHV FDGKLNILVN NAGVVIHKEA KDFTEKDYNI IMGTNFEAAY CC HLSQIAYPLL KASQNGNVIF LSSIAGFSAL PSVSLYSASK GAINQMTKSL ACEWAKDNIR CC VNSVAPGVIL QKEEIDNFIV KTPMGRAGKP QEVSALIAFL CFPAASYITG QIIWADGGFT CC ANGGF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MEESKVSMMNCNNEGRWSLKGTTALVTGGSKGIGYAIVEELAGLGARVYT CC ATOM ---------------RWSLKGTTALVTGGSKGIGYAIVEELAGLGARVYT CC *********************************** CC SEQRES CSRNEKELDECLEIWREKGLNVEGSVCDLLSRTERDKLMQTVAHVFDGKL CC ATOM CSRNEKELDECLEIWREKGLNVEGSVCDLLSRTERDKLMQTVAHVFDGKL CC ************************************************** CC SEQRES NILVNNAGVVIHKEAKDFTEKDYNIIMGTNFEAAYHLSQIAYPLLKASQN CC ATOM NILVNNAGVVIHKEAKDFTEKDYNIIMGTNFEAAYHLSQIAYPLLKASQN CC ************************************************** CC SEQRES GNVIFLSSIAGFSALPSVSLYSASKGAINQMTKSLACEWAKDNIRVNSVA CC ATOM GNVIFLSSIAGFSALPSVSLYSASKGAINQMTKSLACEWAKDNIRVNSVA CC ************************************************** CC SEQRES PGVILTPLVETAIKKNPHQKEEIDNFIVKTPMGRAGKPQEVSALIAFLCF CC ATOM PGVIL-------------QKEEIDNFIVKTPMGRAGKPQEVSALIAFLCF CC ***** ******************************** CC SEQRES PAASYITGQIIWADGGFTANGGF CC ATOM PAASYITGQIIWADGGFTANGGF CC *********************** SQ SEQUENCE 273 AA; MW; CN; MEESKVSMMN CNNEGRWSLK GTTALVTGGS KGIGYAIVEE LAGLGARVYT CSRNEKELDE CLEIWREKGL NVEGSVCDLL SRTERDKLMQ TVAHVFDGKL NILVNNAGVV IHKEAKDFTE KDYNIIMGTN FEAAYHLSQI AYPLLKASQN GNVIFLSSIA GFSALPSVSL YSASKGAINQ MTKSLACEWA KDNIRVNSVA PGVILTPLVE TAIKKNPHQK EEIDNFIVKT PMGRAGKPQE VSALIAFLCF PAASYITGQI IWADGGFTAN GGF // ID 1AE1B STANDARD; PRT; 273 AA. DT CONVERTED FROM PDB (SEQRES) 1AE1 DE TROPINONE REDUCTASE-I OS Datura stramonium CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.155 FT #SUB 82 82 ARG B 120 120 GLU A Protein S 6 FT #SUB 114 114 GLU B 188 188 GLU A Protein A 3 FT #SUB 115 115 ALA B 135 135 TYR A Protein B 5 FT #SUB 115 115 ALA B 139 139 GLN A Protein B 3 FT #SUB 115 115 ALA B 185 185 LEU A Protein S 1 FT #SUB 115 115 ALA B 188 188 GLU A Protein A 7 FT #SUB 116 116 LYS B 139 139 GLN A Protein B 3 FT #SUB 116 116 LYS B 142 142 TYR A Protein S 3 FT #SUB 118 118 PHE B 135 135 TYR A Protein S 3 FT #SUB 118 118 PHE B 139 139 GLN A Protein B 5 FT #SUB 120 120 GLU B 82 82 ARG A Protein S 4 FT #SUB 123 123 TYR B 131 131 PHE A Protein S 3 FT #SUB 123 123 TYR B 132 132 GLU A Protein S 11 FT #SUB 127 127 MET B 123 123 TYR A Protein S 1 FT #SUB 127 127 MET B 127 127 MET A Protein S 1 FT #SUB 131 131 PHE B 123 123 TYR A Protein S 3 FT #SUB 131 131 PHE B 127 127 MET A Protein S 1 FT #SUB 131 131 PHE B 173 173 ALA A Protein S 1 FT #SUB 132 132 GLU B 123 123 TYR A Protein S 10 FT #SUB 135 135 TYR B 115 115 ALA A Protein S 5 FT #SUB 135 135 TYR B 118 118 PHE A Protein S 3 FT #SUB 139 139 GLN B 115 115 ALA A Protein S 3 FT #SUB 139 139 GLN B 116 116 LYS A Protein S 2 FT #SUB 139 139 GLN B 118 118 PHE A Protein S 5 FT #SUB 142 142 TYR B 116 116 LYS A Protein S 3 FT #SUB 160 160 ALA B 180 180 GLN A Protein B 1 FT #SUB 161 161 GLY B 180 180 GLN A Protein B 2 FT #SUB 162 162 PHE B 180 180 GLN A Protein B 4 FT #SUB 162 162 PHE B 183 183 LYS A Protein B 3 FT #SUB 164 164 ALA B 183 183 LYS A Protein S 2 FT #SUB 164 164 ALA B 184 184 SER A Protein S 3 FT #SUB 164 164 ALA B 187 187 CYS A Protein S 1 FT #SUB 169 169 SER B 135 135 TYR A Protein S 1 FT #SUB 169 169 SER B 181 181 MET A Protein B 2 FT #SUB 169 169 SER B 184 184 SER A Protein A 4 FT #SUB 169 169 SER B 188 188 GLU A Protein S 1 FT #SUB 170 170 LEU B 131 131 PHE A Protein S 2 FT #SUB 170 170 LEU B 135 135 TYR A Protein S 1 FT #SUB 170 170 LEU B 181 181 MET A Protein B 2 FT #SUB 172 172 SER B 180 180 GLN A Protein B 3 FT #SUB 173 173 ALA B 131 131 PHE A Protein S 2 FT #SUB 173 173 ALA B 177 177 ALA A Protein A 4 FT #SUB 173 173 ALA B 180 180 GLN A Protein B 1 FT #SUB 173 173 ALA B 181 181 MET A Protein S 1 FT #SUB 176 176 GLY B 176 176 GLY A Protein B 4 FT #SUB 176 176 GLY B 180 180 GLN A Protein B 1 FT #SUB 177 177 ALA B 173 173 ALA A Protein A 3 FT #SUB 177 177 ALA B 177 177 ALA A Protein B 1 FT #SUB 180 180 GLN B 160 160 ALA A Protein S 2 FT #SUB 180 180 GLN B 161 161 GLY A Protein S 3 FT #SUB 180 180 GLN B 162 162 PHE A Protein S 2 FT #SUB 180 180 GLN B 163 163 SER A Protein S 3 FT #SUB 180 180 GLN B 172 172 SER A Protein S 4 FT #SUB 181 181 MET B 169 169 SER A Protein S 2 FT #SUB 181 181 MET B 173 173 ALA A Protein S 1 FT #SUB 183 183 LYS B 162 162 PHE A Protein S 2 FT #SUB 183 183 LYS B 164 164 ALA A Protein B 2 FT #SUB 184 184 SER B 164 164 ALA A Protein B 2 FT #SUB 184 184 SER B 169 169 SER A Protein S 3 FT #SUB 185 185 LEU B 115 115 ALA A Protein S 1 FT #SUB 187 187 CYS B 164 164 ALA A Protein S 1 FT #SUB 188 188 GLU B 114 114 GLU A Protein S 2 FT #SUB 188 188 GLU B 115 115 ALA A Protein S 7 FT #SUB 188 188 GLU B 169 169 SER A Protein S 1 FT #HET 28 28 GLY B 2 274 NAP B B 10 FT #HET 29 29 GLY B 2 274 NAP B B 1 FT #HET 30 30 SER B 2 274 NAP B A 3 FT #HET 31 31 LYS B 2 274 NAP B A 7 FT #HET 32 32 GLY B 2 274 NAP B B 3 FT #HET 33 33 ILE B 2 274 NAP B A 6 FT #HET 52 52 SER B 2 274 NAP B A 5 FT #HET 53 53 ARG B 2 274 NAP B A 27 FT #HET 54 54 ASN B 2 274 NAP B B 1 FT #HET 57 57 GLU B 2 274 NAP B S 1 FT #HET 77 77 CYS B 2 274 NAP B B 4 FT #HET 78 78 ASP B 2 274 NAP B A 5 FT #HET 79 79 LEU B 2 274 NAP B A 12 FT #HET 80 80 LEU B 2 274 NAP B B 1 FT #HET 106 106 ASN B 2 274 NAP B A 9 FT #HET 107 107 ALA B 2 274 NAP B A 5 FT #HET 156 156 LEU B 2 274 NAP B A 4 FT #HET 157 157 SER B 2 274 NAP B B 2 FT #HET 158 158 SER B 2 274 NAP B S 4 FT #HET 171 171 TYR B 2 274 NAP B S 6 FT #HET 175 175 LYS B 2 274 NAP B S 3 FT #HET 201 201 PRO B 2 274 NAP B A 7 FT #HET 202 202 GLY B 2 274 NAP B B 3 FT #HET 203 203 VAL B 2 274 NAP B B 2 FT #HET 204 204 ILE B 2 274 NAP B A 10 FT #HET 206 206 THR B 2 274 NAP B S 8 FT #HET 207 207 PRO B 2 274 NAP B A 4 FT #HET 208 208 LEU B 2 274 NAP B A 9 FT #HET 209 209 VAL B 2 274 NAP B S 2 FT DISORDER 1 15 CC SEQUENCE 258 AA (ATOM); CC RWSLKGTTAL VTGGSKGIGY AIVEELAGLG ARVYTCSRNE KELDECLEIW REKGLNVEGS CC VCDLLSRTER DKLMQTVAHV FDGKLNILVN NAGVVIHKEA KDFTEKDYNI IMGTNFEAAY CC HLSQIAYPLL KASQNGNVIF LSSIAGFSAL PSVSLYSASK GAINQMTKSL ACEWAKDNIR CC VNSVAPGVIL TPLVETAIKK NPHQKEEIDN FIVKTPMGRA GKPQEVSALI AFLCFPAASY CC ITGQIIWADG GFTANGGF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MEESKVSMMNCNNEGRWSLKGTTALVTGGSKGIGYAIVEELAGLGARVYT CC ATOM ---------------RWSLKGTTALVTGGSKGIGYAIVEELAGLGARVYT CC *********************************** CC SEQRES CSRNEKELDECLEIWREKGLNVEGSVCDLLSRTERDKLMQTVAHVFDGKL CC ATOM CSRNEKELDECLEIWREKGLNVEGSVCDLLSRTERDKLMQTVAHVFDGKL CC ************************************************** CC SEQRES NILVNNAGVVIHKEAKDFTEKDYNIIMGTNFEAAYHLSQIAYPLLKASQN CC ATOM NILVNNAGVVIHKEAKDFTEKDYNIIMGTNFEAAYHLSQIAYPLLKASQN CC ************************************************** CC SEQRES GNVIFLSSIAGFSALPSVSLYSASKGAINQMTKSLACEWAKDNIRVNSVA CC ATOM GNVIFLSSIAGFSALPSVSLYSASKGAINQMTKSLACEWAKDNIRVNSVA CC ************************************************** CC SEQRES PGVILTPLVETAIKKNPHQKEEIDNFIVKTPMGRAGKPQEVSALIAFLCF CC ATOM PGVILTPLVETAIKKNPHQKEEIDNFIVKTPMGRAGKPQEVSALIAFLCF CC ************************************************** CC SEQRES PAASYITGQIIWADGGFTANGGF CC ATOM PAASYITGQIIWADGGFTANGGF CC *********************** SQ SEQUENCE 273 AA; MW; CN; MEESKVSMMN CNNEGRWSLK GTTALVTGGS KGIGYAIVEE LAGLGARVYT CSRNEKELDE CLEIWREKGL NVEGSVCDLL SRTERDKLMQ TVAHVFDGKL NILVNNAGVV IHKEAKDFTE KDYNIIMGTN FEAAYHLSQI AYPLLKASQN GNVIFLSSIA GFSALPSVSL YSASKGAINQ MTKSLACEWA KDNIRVNSVA PGVILTPLVE TAIKKNPHQK EEIDNFIVKT PMGRAGKPQE VSALIAFLCF PAASYITGQI IWADGGFTAN GGF //