UniProt O52377
3-dehydroquinate dehydratase (O52377)
3-dehydroquinate dehydratase (UniProt O52377), EC 4.2.1.10: 2 experimental structures and 1 predicted model on GenesisL1, 2 ligands bound, 15 pockets. Binding sites, druggability and experiment against prediction (TM-score) in…
- UniProt
- O52377
- Protein
- 3-dehydroquinate dehydratase
- EC
- 4.2.1.10
- Experimental structures
- 2
- Predicted models
- 1
- Ligands
- 2
- Pockets
- 15 · 2 records with a druggable one
Structures
3 records of O52377 in the MolNFT archive: 2 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 8IDR | Crystal structure of apo-form of dehydroquinate dehydratase from Corynebacterium glutamicum | x-ray diffraction | A, B, C, D | — | 7 (best 0.76) |
| 8IDU | Crystal structure of substrate bound-form dehydroquinate dehydratase from Corynebacterium glutamicum | x-ray diffraction | A, B, C, D, E, F | SO4, DQA | 8 (best 0.80) |
| O52377 | AlphaFold monomer V2.0 prediction for 3-dehydroquinate dehydratase (O52377) | predicted | A | — | — |
Ligands
Experiment against prediction
- 8IDU chain B against the predicted model O52377: TM-score 1.00, RMSD 0.31 Å
- 8IDU chain F against the predicted model O52377: TM-score 0.99, RMSD 0.34 Å
- 8IDU chain C against the predicted model O52377: TM-score 0.99, RMSD 0.34 Å
- 8IDU chain E against the predicted model O52377: TM-score 0.99, RMSD 0.38 Å
- 8IDU chain D against the predicted model O52377: TM-score 0.99, RMSD 0.39 Å
- 8IDR chain A against the predicted model O52377: TM-score 0.98, RMSD 0.33 Å
- 8IDR chain D against the predicted model O52377: TM-score 0.99, RMSD 0.36 Å
- 8IDU chain A against the predicted model O52377: TM-score 0.98, RMSD 0.50 Å
- 8IDR chain C against the predicted model O52377: TM-score 0.95, RMSD 0.98 Å
- 8IDR chain B against the predicted model O52377: TM-score 0.96, RMSD 1.22 Å
Elsewhere
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