UniProt Q9HTJ1
NAD/NADP-dependent betaine aldehyde dehydrogenase (Q9HTJ1)
NAD/NADP-dependent betaine aldehyde dehydrogenase (UniProt Q9HTJ1), EC 1.2.1.8: 15 experimental structures and 1 predicted model on GenesisL1, 2 ligands bound, 16 pockets. Binding sites, druggability and experiment against…
- UniProt
- Q9HTJ1
- Protein
- NAD/NADP-dependent betaine aldehyde dehydrogenase
- EC
- 1.2.1.8
- Experimental structures
- 15
- Predicted models
- 1
- Ligands
- 2
- Pockets
- 16 · 1 record with a druggable one
Structures
16 records of Q9HTJ1 in the MolNFT archive: 15 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 2WME | Crystallographic structure of betaine aldehyde dehydrogenase from Pseudomonas aeruginosa | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 2WME | Crystallographic structure of betaine aldehyde dehydrogenase from pseudomonas aeruginosa | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 2WOX | Betaine aldehyde dehydrogenase from Pseudomonas aeruginosa with NAD(P) H-catalytic thiol adduct. | x-ray diffraction | A, B, C, D | — | — |
| 2WOX | Betaine aldehyde dehydrogenase from pseudomonas aeruginosa with NAD(P) H-catalytic thiol adduct. | x-ray diffraction | A, B, C, D | — | — |
| 2XDR | Crystallographic structure of betaine aldehyde dehydrogenase mutant E252A from pseudomonas… | x-ray diffraction | A, B, C, D | — | — |
| 2XDR | Crystallographic structure of betaine aldehyde dehydrogenase mutant E252A from pseudomonas… | x-ray diffraction | A, B, C, D | — | — |
| 3ZQA | Crystallographic structure of betaine aldehyde dehydrogenase mutant C286A from pseudomonas… | x-ray diffraction | A, B, C, D | — | — |
| 3ZQA | Crystallographic structure of betaine aldehyde dehydrogenase mutant C286A from pseudomonas… | x-ray diffraction | A, B, C, D | — | — |
| 4CAZ | CRYSTAL STRUCTURE OF BETAINE ALDEHYDE DEHYDROGENASE FROM Pseudomonas aeruginosa IN COMPLEX WITH NADH | x-ray diffraction | A, B | — | — |
| 4CAZ | Crystal structure of betaine aldehyde dehydrogenase from pseudomonas aeruginosa in complex with NADH | x-ray diffraction | A, B | — | — |
| 4CBB | APO FORM OF BETAINE ALDEHYDE DEHYDROGENASE FROM Pseudomonas aeruginosa | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 4CBB | Apo form of betaine aldehyde dehydrogenase from pseudomonas aeruginosa | x-ray diffraction | A, B, C, D, E, F, G, H | — | — |
| 6BJP | Apo form of the E124S mutant of betaine aldehyde dehydrogenase from Pseudomonas aeruginosa | x-ray diffraction | A, B, C, D | K | 16 (best 0.77) |
| 6BJP | Apo form of the E124S mutant of betaine aldehyde dehydrogenase from pseudomonas aeruginosa | x-ray diffraction | A, B, C, D | K | — |
| 6BPG | Crystal structure of betaine aldehyde dehydrogenase from pseudomonas aeruginosa with bound rubidium… | x-ray diffraction | A, B, C, D, E, F, G, H | RB | — |
| Q9HTJ1 | AlphaFold monomer V2.0 prediction for NAD/NADP-dependent betaine aldehyde dehydrogenase (Q9HTJ1) | predicted | A | — | — |
Ligands
Experiment against prediction
- 2WOX chain A against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.38 Å
- 2WOX chain A against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.38 Å
- 2XDR chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 2XDR chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 3ZQA chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 3ZQA chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 2WOX chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 2WOX chain C against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 2WOX chain B against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
- 2WOX chain B against the predicted model Q9HTJ1: TM-score 1.00, RMSD 0.40 Å
Elsewhere
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