UniProt A7UD81
Bifunctional dihydrofolate reductase-thymidylate synthase (A7UD81)
Bifunctional dihydrofolate reductase-thymidylate synthase (UniProt A7UD81): 25 experimental structures on GenesisL1, 12 ligands bound, 98 pockets. Binding sites, pockets, druggability and 3D structures in GL1X.
- UniProt
- A7UD81
- Protein
- Bifunctional dihydrofolate reductase-thymidylate synthase
- Experimental structures
- 25
- Predicted models
- 0
- Ligands
- 12
- Pockets
- 98 · 6 records with a druggable one
Structures
25 records of A7UD81 in the MolNFT archive: 25 experimental, 0 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 3QGT | Crystal structure of Wild-type PfDHFR-TS COMPLEXED WITH NADPH, dUMP AND PYRIMETHAMINE | x-ray diffraction | A, B | — | — |
| 3QGT | Crystal structure of wild-type pfdhfr-ts complexed with NADPH, dump and pyrimethamine | x-ray diffraction | A, B | — | — |
| 3UM5 | Double mutant (A16V+S108T) Plasmodium falciparum dihydrofolate reductase-thymidylate synthase… | x-ray diffraction | A, B | — | — |
| 3UM5 | Double mutant (A16V+S108T) plasmodium falciparum dihydrofolate reductase-thymidylate synthase… | x-ray diffraction | A, B | — | — |
| 3UM6 | Double mutant (A16V+S108T) Plasmodium falciparum DHFR-TS (T9/94) complexed with cycloguanil, NADPH… | x-ray diffraction | A, B | — | — |
| 3UM6 | Double mutant (A16V+S108T) plasmodium falciparum DHFR-ts (T9/94) complexed with cycloguanil, NADPH… | x-ray diffraction | A, B | — | — |
| 3UM8 | Wild-type Plasmodium falciparum DHFR-TS complexed with cycloguanil and NADPH | x-ray diffraction | A, B | — | — |
| 3UM8 | Wild-type plasmodium falciparum DHFR-ts complexed with cycloguanil and NADPH | x-ray diffraction | A, B | — | — |
| 4DPD | WILD TYPE PLASMODIUM FALCIPARUM DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE (PfDHFR-TS), DHF… | x-ray diffraction | A, B | — | — |
| 4DPD | Wild type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (pfdhfr-ts), dhf… | x-ray diffraction | A, B | — | — |
| 6A2K | Crystal structure of wild type Plasmodium falciparum DHFR-TS complexed with BT1, NADPH, and dUMP | x-ray diffraction | A, B | 9QO, NAP, UMP | 14 (best 0.74) |
| 6A2K | Crystal structure of wild type plasmodium falciparum DHFR-ts complexed with BT1, NADPH, and dump | x-ray diffraction | A, B | 9QO, NAP, UMP | — |
| 6A2M | Crystal structure of wild type Plasmodium falciparum DHFR-TS complexed with BT2, NADPH, and dUMP | x-ray diffraction | A, B | 9QR, NAP, UMP, PO4 | 16 (best 0.73) |
| 6A2M | Crystal structure of wild type plasmodium falciparum DHFR-ts complexed with BT2, NADPH, and dump | x-ray diffraction | A, B | 9QR, NAP, UMP, PO4 | — |
| 6A2O | Crystal structure of wild type Plasmodium falciparum DHFR-TS complexed with BT3, NADPH, and dUMP | x-ray diffraction | A, B | 9RR, NAP, UMP | — |
| 6A2O | Crystal structure of wild type plasmodium falciparum DHFR-ts complexed with BT3, NADPH, and dump | x-ray diffraction | A, B | 9RR, NAP, UMP | — |
| 7CTW | Wild-type Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed… | x-ray diffraction | A, B | NDP, GEX, PO4 | 19 (best 0.74) |
| 7CTW | Wild-type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (pfdhfr-ts) complexed… | x-ray diffraction | A, B | NDP, GEX, PO4 | — |
| 7CTY | Wild type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS), fragment… | x-ray diffraction | A, B | NDP, GF3, PO4 | 17 (best 0.74) |
| 7CTY | Wild type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (pfdhfr-ts), fragment… | x-ray diffraction | A, B | NDP, GF3, PO4 | — |
| 7CTZ | Wild-type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed… | x-ray diffraction | A, B | NDP, UMP, GF6 | — |
| 7CTZ | Wild-type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (pfdhfr-ts) complexed… | x-ray diffraction | A, B | NDP, UMP, GF6 | — |
| 7F3Y | Wild-type Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS) complexed… | x-ray diffraction | A, B | NDP, MTX, UMP | 17 (best 0.73) |
| 7F3Y | Wild-type plasmodium falciparum dihydrofolate reductase-thymidylate synthase (pfdhfr-ts) complexed… | x-ray diffraction | A, B | NDP, UMP | — |
| 8WGM | Quadruple mutant Plasmodium falciparum dihydrofolate reductase-thymidylate synthase (PfDHFR-TS… | x-ray diffraction | A, B | NDP, UMP, WCQ | 15 (best 0.74) |
Ligands
- UMP · 2'-deoxyuridine 5'-monophosphate · in 11 records
- NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · in 9 records
- NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · in 6 records
- PO4 · Phosphate ion · in 6 records
- 9QO · 5-(3-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl) oxy]propoxy}phenyl)-6-ethylpyrimidine-2,4-diamine · in 2 records
- 9QR · 5-(4-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl) oxy]propoxy}phenyl)-6-ethylpyrimidine-2,4-diamine · in 2 records
- 9RR · 5,5'-[propane-1,3-diylbis(oxy-4,1-phenylene)]bis(6-ethylpyrimidine-2,4-diamine) · in 2 records
- GEX · 1-(2-methylsulfanylphenyl)piperazine · in 2 records
- GF3 · spiro[1H-2-benzofuran-3,4'-piperidine] · in 2 records
- GF6 · 1-[3-(trifluoromethyl)phenyl]urea · in 2 records
- MTX · Methotrexate · in 1 record
- WCQ · (3~{E})-3-[[2-[3-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]oxypropoxy]phenyl]methylidene]oxolan-2-one · in 1 record
Elsewhere
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