UniProt Q07422
Q07422
Q07422 (UniProt Q07422): 17 experimental structures and 1 predicted model on GenesisL1, 10 ligands bound. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q07422
- Experimental structures
- 17
- Predicted models
- 1
- Ligands
- 10
Structures
18 records of Q07422 in the MolNFT archive: 17 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 4ECK | Crystal Structure of the Toxoplasma gondii TS-DHFR | x-ray diffraction | A, B | — | — |
| 4ECK | Crystal structure of the toxoplasma gondii ts-DHFR | x-ray diffraction | A, B | — | — |
| 4EIL | Crystal Structure of the loop truncated Toxoplasma gondii TS-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4EIL | Crystal structure of the loop truncated toxoplasma gondii ts-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4KY4 | Crystal structure of non-classical TS inhibitor 2 in complex with Toxoplasma gondii TS-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4KY4 | Crystal structure of non-classical ts inhibitor 2 in complex with toxoplasma gondii ts-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4KYA | Crystal structure of non-classical TS inhibitor 3 in complex with Toxoplasma gondii TS-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4KYA | Crystal structure of non-classical ts inhibitor 3 in complex with toxoplasma gondii ts-DHFR | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 5T0L | Crystal structure of toxoplasma gondii ts-DHFR complexed with NADPH, dump, pddf and… | x-ray diffraction | A, B | UMP, NDP, 73X | — |
| 6AOG | Crystal structure of toxoplasma gondii ts-DHFR complexed with NADPH, dump, pddf, and… | x-ray diffraction | A, B | UMP, NDP, CP6 | — |
| 6AOH | Crystal structure of toxoplasma gondii ts-DHFR complexed with NADPH, dump, pddf, and… | x-ray diffraction | A, B | UMP, NDP, BOD | — |
| 6AOI | Crystal structure of toxoplasma gondii ts-DHFR complexed with NADPH, dump, pddf, and… | x-ray diffraction | A, B | UMP, NDP, BOJ | — |
| 6N1S | Toxoplasma gondii ts-DHFR in complex with selective inhibitor 29 | x-ray diffraction | A, B | UMP, NDP, K9A | — |
| 6N1T | Toxoplasma gondii ts-DHFR in complex with selective inhibitor 3 | x-ray diffraction | A, B | UMP, NDP, BOD | — |
| 7FGW | Toxoplasma gondii dihydrofolate reductase thymidylate synthase (tgdhfr-ts) complexed with… | x-ray diffraction | A, B, C, D | NDP, CP6, BEN, UMP | — |
| 7FGX | Toxoplasma gondii dihydrofolate reductase thymidylate synthase (tgdhfr-ts) complexed with P39… | x-ray diffraction | A, B, C, D | NDP, 4RI, UMP | — |
| 7FGY | Toxoplasma gondii dihydrofolate reductase thymidylate synthase (tgdhfr-ts) complexed with P40… | x-ray diffraction | A, B, C, D | NDP, 4TS, UMP | — |
| Q07422 | AlphaFold monomer V2.0 prediction for bifunctional dihydrofolate reductase-thymidylate synthase… | predicted | A | — | — |
Ligands
- NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · in 9 records
- UMP · 2'-deoxyuridine 5'-monophosphate · in 9 records
- BOD · 5-{4-[3-(2-methoxypyrimidin-5-yl)phenyl]piperazin-1-yl}pyrimidine-2,4-diamine · in 2 records
- CP6 · 5-(4-chloro-phenyl)-6-ethyl-pyrimidine-2,4-diamine · in 2 records
- 4RI · 6-hexyl-5-phenyl-pyrimidine-2,4-diamine · in 1 record
- 4TS · 5-(3-chlorophenyl)-6-[2-(3-phenoxypropoxy) ethyl]pyrimidine-2,4-diamine · in 1 record
- 73X · 5-[4-(3,4-dichlorophenyl)piperazin-1-yl]pyrimidine-2,4-diamine · in 1 record
- BEN · Benzamidine · in 1 record
- BOJ · 5-(4-phenylpiperazin-1-yl)-6-propylpyrimidine-2,4-diamine · in 1 record
- K9A · 5-{4-[3-(2-methylpyrimidin-5-yl)phenyl]piperazin-1-yl}pyrimidine-2,4-diamine · in 1 record
Experiment against prediction
- 5T0L chain B against the predicted model Q07422: TM-score 0.99, RMSD 0.51 Å
- 6AOG chain A against the predicted model Q07422: TM-score 0.99, RMSD 0.51 Å
- 5T0L chain A against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 4KYA chain C against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 4KYA chain E against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 4KYA chain G against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 6AOI chain A against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 4KYA chain A against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 4KYA chain A against the predicted model Q07422: TM-score 0.99, RMSD 0.52 Å
- 6AOG chain B against the predicted model Q07422: TM-score 0.99, RMSD 0.54 Å
Elsewhere
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