UniProt Q46509
Aldehyde oxidoreductase (Q46509)
Aldehyde oxidoreductase (UniProt Q46509), EC 1.2.3.1: 22 experimental structures and 1 predicted model on GenesisL1, 5 ligands bound, 22 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q46509
- Protein
- Aldehyde oxidoreductase
- EC
- 1.2.3.1
- Experimental structures
- 22
- Predicted models
- 1
- Ligands
- 5
- Pockets
- 22 · 3 records with a druggable one
Structures
23 records of Q46509 in the MolNFT archive: 22 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1SIJ | Crystal structure of the Aldehyde Dehydrogenase (a.k.a. AOR or MOP) of Desulfovibrio gigas… | x-ray diffraction | A | CL, MG, PCD, AST, FES | 7 (best 0.80) |
| 1SIJ | Crystal structure of the aldehyde dehydrogenase (A.K.A. aor or mop) of desulfovibrio gigas… | x-ray diffraction | A | — | — |
| 1VLB | Structure refinement of the aldehyde oxidoreductase from desulfovibrio gigas at 1.28 a | x-ray diffraction | A | CL, MG, PCD, FES | 6 (best 0.81) |
| 1VLB | Structure refinement of the aldehyde oxidoreductase from desulfovibrio gigas at 1.28 a | x-ray diffraction | A | — | — |
| 3FAH | Glycerol inhibited form of Aldehyde oxidoreductase from Desulfovibrio gigas | x-ray diffraction | A | — | — |
| 3FAH | Glycerol inhibited form of aldehyde oxidoreductase from desulfovibrio gigas | x-ray diffraction | A | — | — |
| 3FC4 | Ethylene glycol inhibited form of Aldehyde oxidoreductase from Desulfovibrio gigas | x-ray diffraction | A | — | — |
| 3FC4 | Ethylene glycol inhibited form of aldehyde oxidoreductase from desulfovibrio gigas | x-ray diffraction | A | — | — |
| 3L4P | Crystal structure of the Aldehyde Dehydrogenase (a.k.a. AOR or MOP) of Desulfovibrio gigas… | x-ray diffraction | A | — | — |
| 3L4P | Crystal structure of the aldehyde dehydrogenase (A.K.A. aor or mop) of desulfovibrio gigas… | x-ray diffraction | A | — | — |
| 4C7Y | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with sodium dithionite and sodium… | x-ray diffraction | A | — | — |
| 4C7Y | Aldehyde oxidoreductase from desulfovibrio gigas (mop), soaked with sodium dithionite and sodium… | x-ray diffraction | A | — | — |
| 4C7Z | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), activated with sodium dithionite and sodium… | x-ray diffraction | A | — | — |
| 4C7Z | Aldehyde oxidoreductase from desulfovibrio gigas (mop), activated with sodium dithionite and sodium… | x-ray diffraction | A | — | — |
| 4C80 | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with hydrogen peroxide | x-ray diffraction | A | — | — |
| 4C80 | Aldehyde oxidoreductase from desulfovibrio gigas (mop), soaked with hydrogen peroxide | x-ray diffraction | A | — | — |
| 4US8 | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with benzaldehyde | x-ray diffraction | A | — | — |
| 4US8 | Aldehyde oxidoreductase from desulfovibrio gigas (mop), soaked with benzaldehyde | x-ray diffraction | A | — | — |
| 4US9 | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with 3- phenylpropionaldehyde | x-ray diffraction | A | — | — |
| 4US9 | Aldehyde oxidoreductase from desulfovibrio gigas (mop), soaked with 3- phenylpropionaldehyde | x-ray diffraction | A | — | — |
| 4USA | Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with trans-cinnamaldehyde | x-ray diffraction | A | — | — |
| 4USA | Aldehyde oxidoreductase from desulfovibrio gigas (mop), soaked with trans-cinnamaldehyde | x-ray diffraction | A | — | — |
| Q46509 | AlphaFold monomer V2.0 prediction for aldehyde oxidoreductase (Q46509) | predicted | A | — | 9 (best 0.85) |
Ligands
Experiment against prediction
- 1SIJ chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.49 Å
- 1SIJ chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.49 Å
- 4C7Y chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.49 Å
- 4C7Y chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.49 Å
- 3FC4 chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
- 3FC4 chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
- 4C80 chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
- 4C80 chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
- 1VLB chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
- 1VLB chain A against the predicted model Q46509: TM-score 1.00, RMSD 0.50 Å
Elsewhere
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