DrugDomain logoDrugDomain

Attributes

UniProt ID
A4JLJ7
Protein Name
Aldehyde dehydrogenase
Ligand Name
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
DB02338
PDB Ligand Accession
NDP
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.

Mol*
Structure: 5KF0
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Color Legend
Unassigned regionsLigand / hetero atomse5kf0A1e5kf0A2e5kf0B1e5kf0B2e5kf0C1e5kf0C2e5kf0D1e5kf0D2
ECOD domains from experimental PDB structures interacting with ligand DB02338
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
A4JLJ7DB02338NDP5kf0e5kf0A1A:-2-251
A4JLJ7DB02338NDP5kf0e5kf0A2A:252-477
A4JLJ7DB02338NDP5kf0e5kf0B1B:252-477
A4JLJ7DB02338NDP5kf0e5kf0B2B:2-251
A4JLJ7DB02338NDP5kf0e5kf0C1C:252-477
A4JLJ7DB02338NDP5kf0e5kf0C2C:2-251
A4JLJ7DB02338NDP5kf0e5kf0D1D:2-251
A4JLJ7DB02338NDP5kf0e5kf0D2D:252-477