DRUG BINDING INTERFACES MAPPED TO 'TRIMETREXATE'
DrReposER ID | PDB | Ligand | Organism | Macromolecule | Pfam | Res. | Interface | HETATM |
---|---|---|---|---|---|---|---|---|
1BZF_A_TMQA170 | 1bzf | TMQ DB01157(Trimetrexate) | Lactobacilluscasei | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 12 | LEU A 4ALA A 6HIS A 18LEU A 19ASP A 26LEU A 27PHE A 30THR A 45PHE A 49LEU A 54ALA A 97THR A 116 | TMQ A 170 |
2X9V_A_TMQA1270 | 2x9v | TMQ DB01157(Trimetrexate) | Trypanosomabrucei | PTERIDINE REDUCTASE | PF13561(adh_short_C2) | 11 | ARG A 14SER A 95PHE A 97ASP A 161CYS A 168TYR A 174LEU A 209PRO A 210MET A 213GLU A 217TRP A 221 | TMQ A1270 |
2X9V_B_TMQB1270 | 2x9v | TMQ DB01157(Trimetrexate) | Trypanosomabrucei | PTERIDINE REDUCTASE | no annotation | 9 | ARG B 14SER B 95PHE B 97ASP B 161CYS B 168TYR B 174LEU B 209PRO B 210MET B 213 | TMQ B1270 |
2X9V_C_TMQC1270 | 2x9v | TMQ DB01157(Trimetrexate) | Trypanosomabrucei | PTERIDINE REDUCTASE | no annotation | 10 | ARG C 14SER C 95PHE C 97ASP C 161CYS C 168PHE C 171TYR C 174LEU C 209PRO C 210MET C 213 | TMQ C1270 |
2X9V_D_TMQD1270 | 2x9v | TMQ DB01157(Trimetrexate) | Trypanosomabrucei | PTERIDINE REDUCTASE | no annotation | 9 | SER D 95PHE D 97ASP D 161CYS D 168PHE D 171TYR D 174LEU D 209PRO D 210MET D 213 | TMQ D1270 |
3CLB_A_TMQA611 | 3clb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DHFR-TS | PF00186(DHFR_1)PF00303(Thymidylat_synt) | 11 | VAL A 26ALA A 28ILE A 41ASP A 48MET A 49ILE A 84PRO A 85LEU A 91ILE A 154TYR A 160THR A 178 | TMQ A 611 |
3CLB_B_TMQB612 | 3clb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DHFR-TS | no annotation | 13 | VAL B 26ALA B 28ILE B 41ASP B 48MET B 49PHE B 52THR B 80SER B 83ILE B 84PRO B 85PHE B 88ILE B 154TYR B 160 | TMQ B 612 |
3CLB_C_TMQC613 | 3clb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DHFR-TS | no annotation | 12 | VAL C 26ALA C 28ILE C 41ASP C 48MET C 49THR C 80ILE C 84PRO C 85LEU C 91ILE C 154TYR C 160THR C 178 | TMQ C 613 |
3CLB_D_TMQD614 | 3clb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DHFR-TS | no annotation | 10 | VAL D 26ALA D 28ILE D 41ASP D 48MET D 49ILE D 84PRO D 85ILE D 154TYR D 160THR D 178 | TMQ D 614 |
3HBB_A_TMQA611 | 3hbb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE | PF00186(DHFR_1)PF00303(Thymidylat_synt) | 10 | VAL A 26ALA A 28ILE A 41ASP A 48MET A 49ILE A 84PRO A 85LEU A 91ILE A 154TYR A 160 | TMQ A 611 |
3HBB_B_TMQB612 | 3hbb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE | no annotation | 9 | VAL B 26ALA B 28ILE B 41ASP B 48THR B 80SER B 83PHE B 88ILE B 154TYR B 160 | TMQ B 612 |
3HBB_C_TMQC613 | 3hbb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE | no annotation | 11 | VAL C 26ALA C 28ILE C 41ASP C 48MET C 49ILE C 84PRO C 85LEU C 91ILE C 154TYR C 160THR C 178 | TMQ C 613 |
3HBB_D_TMQD614 | 3hbb | TMQ DB01157(Trimetrexate) | Trypanosoma cruzi | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE | no annotation | 10 | VAL D 26ALA D 28ILE D 41ASP D 48MET D 49ILE D 84PRO D 85ILE D 154TYR D 160THR D 178 | TMQ D 614 |
4M2X_A_TMQA202 | 4m2x | TMQ DB01157(Trimetrexate) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | PF00186(DHFR_1) | 15 | ILE A 5TRP A 6ALA A 7ASP A 19ILE A 20ARG A 23ASP A 27GLN A 28PHE A 31LEU A 50PRO A 51LEU A 57ILE A 94TYR A 100THR A 113 | TMQ A 202 |
4M2X_C_TMQC202 | 4m2x | TMQ DB01157(Trimetrexate) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | no annotation | 13 | ILE C 5TRP C 6ALA C 7ILE C 20ARG C 23ASP C 27GLN C 28LEU C 50PRO C 51LEU C 57ILE C 94TYR C 100THR C 113 | TMQ C 202 |
4M2X_E_TMQE202 | 4m2x | TMQ DB01157(Trimetrexate) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | no annotation | 14 | ILE E 5TRP E 6ALA E 7ASP E 19ILE E 20ARG E 23ASP E 27GLN E 28LEU E 50PRO E 51LEU E 57ILE E 94TYR E 100THR E 113 | TMQ E 202 |
4M2X_G_TMQG202 | 4m2x | TMQ DB01157(Trimetrexate) | Mycobacteriumtuberculosis | DIHYDROFOLATEREDUCTASE | no annotation | 13 | ILE G 5TRP G 6ALA G 7ILE G 20ARG G 23ASP G 27GLN G 28LEU G 50PRO G 51VAL G 54ILE G 94TYR G 100THR G 113 | TMQ G 202 |
4XT8_A_TMQA302 | 4xt8 | TMQ DB01157(Trimetrexate) | Mycobacteriumtuberculosis | RV2671 | PF01872(RibD_C) | 12 | ASN A 44ILE A 46SER A 59GLY A 60ALA A 63ASP A 67PHE A 71ARG A 75GLU A 91TYR A 93GLU A 193THR A 214 | TMQ A 302 |