Attributes
UniProt ID
Protein Name
Aldehyde dehydrogenase
Ligand Name
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ACFIXJIJDZMPPO-NNYOXOHSSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)OP(=O)(O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4H73
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Color Legend
Unassigned regionsLigand / hetero atomse4h73A1e4h73A2e4h73B1e4h73B2e4h73C1e4h73C2e4h73D1e4h73D2e4h73E1e4h73E2e4h73F1e4h73F2e4h73G1e4h73G2e4h73H1e4h73H2
ECOD domains from experimental PDB structures interacting with ligand DB02338
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73A1 | A:9-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73A2 | A:256-490 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73B1 | B:7-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73B2 | B:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73C1 | C:7-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73C2 | C:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73D1 | D:7-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73D2 | D:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73E1 | E:9-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73E2 | E:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73F1 | F:7-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73F2 | F:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73G1 | G:8-255 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73G2 | G:256-491 |
| G7VCG0 | DB02338 | NDP | 4h73 | e4h73H2 | H:9-255 |