UniProt A9A1T2
Methylphosphonate synthase (A9A1T2)
Methylphosphonate synthase (UniProt A9A1T2), EC 1.13.11.73: 4 experimental structures and 1 predicted model on GenesisL1, 2 ligands bound, 43 pockets. Binding sites, druggability and experiment against prediction (TM-score) in…
- UniProt
- A9A1T2
- Protein
- Methylphosphonate synthase
- EC
- 1.13.11.73
- Experimental structures
- 4
- Predicted models
- 1
- Ligands
- 2
- Pockets
- 43 · 3 records with a druggable one
Structures
5 records of A9A1T2 in the MolNFT archive: 4 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 6B9S | MPnS crystallized in the absence of substrate | x-ray diffraction | A, D, C, F, G, B, E, H | FE | 20 (best 0.88) |
| 6B9S | Mpns crystallized in the absence of substrate | x-ray diffraction | A, D, C, F, G, B, E, H | FE | — |
| 6B9T | Crystal structure of MPnS with substrate 2-hydroxyethylphosphonate (2-HEP) and Fe(II) bound | x-ray diffraction | A, B, C, D, E, F, G, H | FE, 2HE | 20 (best 0.84) |
| 6B9T | Crystal structure of mpns with substrate 2-hydroxyethylphosphonate (2- hep) and FE(II) bound | x-ray diffraction | A, B, C, D, E, F, G, H | FE, 2HE | — |
| A9A1T2 | AlphaFold monomer V2.0 prediction for methylphosphonate synthase (A9A1T2) | predicted | A | — | 3 (best 0.62) |
Ligands
Experiment against prediction
- 6B9T chain B against the predicted model A9A1T2: TM-score 0.99, RMSD 0.69 Å
- 6B9T chain B against the predicted model A9A1T2: TM-score 0.99, RMSD 0.69 Å
- 6B9T chain G against the predicted model A9A1T2: TM-score 0.99, RMSD 0.70 Å
- 6B9T chain H against the predicted model A9A1T2: TM-score 0.99, RMSD 0.70 Å
- 6B9T chain H against the predicted model A9A1T2: TM-score 0.99, RMSD 0.70 Å
- 6B9T chain A against the predicted model A9A1T2: TM-score 0.99, RMSD 0.74 Å
- 6B9T chain A against the predicted model A9A1T2: TM-score 0.99, RMSD 0.74 Å
- 6B9T chain E against the predicted model A9A1T2: TM-score 0.99, RMSD 0.78 Å
- 6B9T chain E against the predicted model A9A1T2: TM-score 0.99, RMSD 0.78 Å
- 6B9T chain C against the predicted model A9A1T2: TM-score 0.99, RMSD 0.79 Å
Elsewhere
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