DRUG BINDING INTERFACES MAPPED TO 'TOP'
List of Binding Interfaces (Click on the entry ID to view details of interfaces and pattern clusters) (Note that ASSAM search use only 3-12 residue containing patterns)DrReposER ID | PDB | Ligand | Organism | Macromolecule | Pfam | Res. | Interface | HETATM |
---|---|---|---|---|---|---|---|---|
1DG5_A_TOPA201 | 1dg5 | TOP DB00440(Trimethoprim) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | ILE A 5TRP A 6ALA A 7ILE A 20ASP A 27PHE A 31SER A 49LEU A 50PRO A 51ILE A 94TYR A 100 | TOP A 201 |
1DYR_A_TOPA407 | 1dyr | TOP DB00440(Trimethoprim) | Pneumocystiscarinii | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | ILE A 10ALA A 12LEU A 25GLU A 32ILE A 33PHE A 36ILE A 65PRO A 66ILE A 123TYR A 129THR A 144 | TOP A 407 |
2BFM_A_TOPA1290 | 2bfm | TOP DB00440(Trimethoprim) | Leishmaniamajor | PTERIDINE REDUCTASE1 | PF00106(adh_short)PF13561(adh_short_C2)no annotation | 9 | PHE A 113ASP A 181LEU A 188TYR A 194LEU A 226LEU A 229HIS A 241TYR A 283ARG D 287 | TOP A1290 |
2BFM_B_TOPB1290 | 2bfm | TOP DB00440(Trimethoprim) | Leishmaniamajor | PTERIDINE REDUCTASE1 | no annotation | 9 | PHE B 113ASP B 181LEU B 188TYR B 191TYR B 194LEU B 226LEU B 229HIS B 241ARG C 287 | TOP B1290 |
2W3A_A_TOPA1190 | 2w3a | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | ILE A 7ALA A 9GLU A 30PHE A 31PHE A 34THR A 56ILE A 60PRO A 61VAL A 115TYR A 121THR A 136 | TOP A1190 |
2W3A_B_TOPB1189 | 2w3a | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | no annotation | 10 | ILE B 7ALA B 9GLU B 30PHE B 31PHE B 34THR B 56ILE B 60LEU B 67TYR B 121THR B 136 | TOP B1189 |
2W3V_A_TOPA1169 | 2w3v | TOP DB00440(Trimethoprim) | Mycobacteriumavium | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 12 | VAL A 9TRP A 10ALA A 11ILE A 24ASP A 31LEU A 32PHE A 35SER A 53LEU A 54ILE A 102TYR A 108THR A 121 | TOP A1169 |
2W9G_A_TOPA1159 | 2w9g | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 10 | LEU A 5ALA A 7LEU A 20ASP A 27LEU A 28VAL A 31SER A 49ILE A 50PHE A 92THR A 111 | TOP A1159 |
2W9H_A_TOPA1160 | 2w9h | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 10 | LEU A 5ALA A 7LEU A 20ASP A 27LEU A 28VAL A 31SER A 49ILE A 50PHE A 92THR A 111 | TOP A1160 |
2W9S_A_TOPA1160 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | PF00186(DHFR_1) | 11 | ILE A 5ALA A 7LEU A 20ASP A 27LEU A 28ILE A 31SER A 49ILE A 50PHE A 92TYR A 98THR A 111 | TOP A1160 |
2W9S_B_TOPB1160 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | no annotation | 11 | ILE B 5ALA B 7LEU B 20ASP B 27LEU B 28ILE B 31SER B 49ILE B 50PHE B 92TYR B 98THR B 111 | TOP B1160 |
2W9S_C_TOPC1160 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | no annotation | 10 | ILE C 5ALA C 7LEU C 20ASP C 27ILE C 31SER C 49ILE C 50PHE C 92TYR C 98THR C 111 | TOP C1160 |
2W9S_D_TOPD1158 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | no annotation | 10 | ILE D 5ALA D 7LEU D 20ASP D 27LEU D 28ILE D 31SER D 49PHE D 92TYR D 98THR D 111 | TOP D1158 |
2W9S_E_TOPE1160 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | no annotation | 8 | ILE E 5ALA E 7LEU E 20ASP E 27ILE E 31PHE E 92TYR E 98THR E 111 | TOP E1160 |
2W9S_F_TOPF1159 | 2w9s | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 | no annotation | 10 | ILE F 5ALA F 7LEU F 20ASP F 27LEU F 28ILE F 31SER F 49PHE F 92TYR F 98THR F 111 | TOP F1159 |
3FL9_A_TOPA200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | PF00186(DHFR_1) | 10 | MET A 6ALA A 8LEU A 21GLU A 28VAL A 32ALA A 50ILE A 51LEU A 55PHE A 96TYR A 102 | TOP A 200 |
3FL9_B_TOPB200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 12 | MET B 6ALA B 8ASN B 20LEU B 21GLU B 28LEU B 29VAL B 32ILE B 51LEU B 55PHE B 96TYR B 102THR B 115 | TOP B 200 |
3FL9_C_TOPC200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 11 | MET C 6ALA C 8ASN C 20LEU C 21GLU C 28LEU C 29VAL C 32ILE C 51LEU C 55PHE C 96THR C 115 | TOP C 200 |
3FL9_D_TOPD200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 9 | MET D 6ALA D 8LEU D 21GLU D 28VAL D 32ILE D 51LEU D 55PHE D 96TYR D 102 | TOP D 200 |
3FL9_E_TOPE200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 10 | MET E 6ALA E 8LEU E 21GLU E 28LEU E 29VAL E 32ILE E 51LEU E 55PHE E 96THR E 115 | TOP E 200 |
3FL9_F_TOPF200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 10 | MET F 6ALA F 8ASN F 20LEU F 21GLU F 28VAL F 32ALA F 50ILE F 51LEU F 55PHE F 96 | TOP F 200 |
3FL9_G_TOPG200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 12 | MET G 6ALA G 8ASN G 20LEU G 21GLU G 28LEU G 29VAL G 32ILE G 51LEU G 55PHE G 96TYR G 102THR G 115 | TOP G 200 |
3FL9_H_TOPH200 | 3fl9 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE (DHFR) | no annotation | 9 | MET H 6ALA H 8GLU H 28LEU H 29VAL H 32ILE H 51LEU H 55PHE H 96THR H 115 | TOP H 200 |
3FRB_X_TOPX300 | 3frb | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | LEU X 5ALA X 7LEU X 20ASP X 27LEU X 28VAL X 31SER X 49ILE X 50PHE X 92TYR X 98THR X 111 | TOP X 300 |
3FRE_X_TOPX300 | 3fre | TOP DB00440(Trimethoprim) | Staphylococcusaureus | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 9 | ALA X 7LEU X 20ASP X 27LEU X 28VAL X 31SER X 49ILE X 50PHE X 92THR X 111 | TOP X 300 |
3JW3_A_TOPA208 | 3jw3 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 10 | MET A 6ALA A 8GLU A 28LEU A 29VAL A 32ILE A 51LEU A 55ILE A 96TYR A 102THR A 115 | TOP A 208 |
3JW3_B_TOPB208 | 3jw3 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE | no annotation | 9 | MET B 6ALA B 8LEU B 21GLU B 28VAL B 32ILE B 51LEU B 55ILE B 96TYR B 102 | TOP B 208 |
3JW5_A_TOPA208 | 3jw5 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | MET A 6ALA A 8ASN A 20LEU A 21GLU A 28LEU A 29VAL A 32ASN A 47ILE A 51PHE A 96THR A 115 | TOP A 208 |
3JW5_B_TOPB208 | 3jw5 | TOP DB00440(Trimethoprim) | Bacillusanthracis | DIHYDROFOLATEREDUCTASE | no annotation | 10 | MET B 6ALA B 8LEU B 21GLU B 28LEU B 29VAL B 32ILE B 51LEU B 55PHE B 96THR B 115 | TOP B 208 |
3N0H_A_TOPA187 | 3n0h | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 11 | ILE A 7ALA A 9GLU A 30PHE A 31PHE A 34THR A 56ILE A 60LEU A 67VAL A 115TYR A 121THR A 136 | TOP A 187 |
3N0H_A_TOPA191 | 3n0h | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 4 | ASP A 21PRO A 61LYS A 63PHE A 64 | TOP A 191 |
3S3V_A_TOPA187 | 3s3v | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 12 | ILE A 7ALA A 9GLU A 30PHE A 31PHE A 34LYS A 35THR A 56ILE A 60LEU A 67VAL A 115TYR A 121THR A 136 | TOP A 187 |
3S3V_A_TOPA193 | 3s3v | TOP DB00440(Trimethoprim) | Homo sapiens | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 5 | ASP A 21LEU A 22ILE A 60PRO A 61PHE A 64 | TOP A 193 |
3TQ8_A_TOPA2001 | 3tq8 | TOP DB00440(Trimethoprim) | Coxiellaburnetii | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 9 | ILE A 6ALA A 8LEU A 21ASP A 28PHE A 32SER A 50ILE A 51ILE A 96THR A 115 | TOP A2001 |
4G8Z_X_TOPX301 | 4g8z | TOP DB00440(Trimethoprim) | Pneumocystisjirovecii | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 10 | ILE X 10ALA X 12LEU X 25GLU X 32PHE X 36SER X 64PRO X 66ILE X 123TYR X 129THR X 144 | TOP X 301 |
4KM2_A_TOPA202 | 4km2 | TOP DB00440(Trimethoprim) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 13 | ILE A 5TRP A 6ALA A 7ILE A 20ASP A 27PHE A 31THR A 46LEU A 50VAL A 54LEU A 57ILE A 94TYR A 100THR A 113 | TOP A 202 |
4KM2_B_TOPB202 | 4km2 | TOP DB00440(Trimethoprim) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | no annotation | 13 | ILE B 5TRP B 6ALA B 7ILE B 20ASP B 27PHE B 31THR B 46LEU B 50VAL B 54LEU B 57ILE B 94TYR B 100THR B 113 | TOP B 202 |
4XT7_A_TOPA302 | 4xt7 | TOP DB00440(Trimethoprim) | Mycobacteriumtuberculosis | RV2671 | PF01872(RibD_C) | 11 | ASN A 44ILE A 46THR A 58SER A 59GLY A 60ASP A 67ARG A 68PHE A 71GLU A 91GLU A 193THR A 214 | TOP A 302 |