UniProt P11731
Dihydrofolate reductase type 5 (P11731)
Dihydrofolate reductase type 5 (UniProt P11731), EC 1.5.1.3: 5 experimental structures and 1 predicted model on GenesisL1, 6 ligands bound, 6 pockets. Binding sites, druggability and experiment against prediction (TM-score) in…
- UniProt
- P11731
- Protein
- Dihydrofolate reductase type 5
- EC
- 1.5.1.3
- Experimental structures
- 5
- Predicted models
- 1
- Ligands
- 6
- Pockets
- 6 · 2 records with a druggable one
Structures
6 records of P11731 in the MolNFT archive: 5 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 7R6G | Crystal structure of DfrA5 dihydrofolate reductase in complex with TRIMETHOPRIM and NADPH | x-ray diffraction | A, B | TOP, NDP, SO4 | 2 (best 0.73) |
| 7R6G | Crystal structure of DFRA5 dihydrofolate reductase in complex with trimethoprim and NADPH | x-ray diffraction | A, B | TOP, NDP, SO4 | — |
| 7RGK | DFRA5 complexed with NADPH and 5-(3-(7-(4-(AMINOMETHYL)PHENYL)… | x-ray diffraction | A, B | NAP, SO4, 560 | — |
| 7RGO | DfrA5 complexed with NADPH and 4'-chloro-3'-(4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl)-[1… | x-ray diffraction | A, B | NAP, 4SI, SO4 | 4 (best 0.70) |
| 7RGO | DFRA5 complexed with NADPH and 4'-chloro-3'-(4-(2,4-diamino-6… | x-ray diffraction | A, B | NAP, 4SI, SO4 | — |
| P11731 | AlphaFold monomer V2.0 prediction for dihydrofolate reductase type 5 (P11731) | predicted | A | — | — |
Ligands
- SO4 · Sulfate ion · in 5 records
- NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · in 3 records
- 4SI · 4'-chloro-3'-[(2S)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl][1,1'-biphenyl]-4-carboxamide · in 2 records
- NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · in 2 records
- TOP · Trimethoprim · in 2 records
- 560 · 5-[(3R)-3-{7-[4-(aminomethyl)phenyl]-2H-1,3-benzodioxol-5-yl}but-1-yn-1-yl]-6-ethylpyrimidine-2,4-diamine · in 1 record
Experiment against prediction
- 7RGK chain B against the predicted model P11731: TM-score 0.99, RMSD 0.37 Å
- 7RGO chain B against the predicted model P11731: TM-score 0.99, RMSD 0.40 Å
- 7RGO chain B against the predicted model P11731: TM-score 0.99, RMSD 0.40 Å
- 7R6G chain B against the predicted model P11731: TM-score 0.99, RMSD 0.43 Å
- 7R6G chain B against the predicted model P11731: TM-score 0.99, RMSD 0.43 Å
- 7RGO chain A against the predicted model P11731: TM-score 0.99, RMSD 0.50 Å
- 7RGO chain A against the predicted model P11731: TM-score 0.99, RMSD 0.50 Å
- 7RGK chain A against the predicted model P11731: TM-score 0.99, RMSD 0.52 Å
- 7R6G chain A against the predicted model P11731: TM-score 0.99, RMSD 0.53 Å
- 7R6G chain A against the predicted model P11731: TM-score 0.99, RMSD 0.53 Å
Elsewhere
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