DrugDomain logoDrugDomain

Attributes

UniProt ID
Q92ND9
Protein Name
Aldehyde dehydrogenase
Ligand Name
NICOTINAMIDE-ADENINE-DINUCLEOTIDE
DrugBank ID
DB14128
PDB Ligand Accession
NAD
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BAWFJGJZGIEFAR-NNYOXOHSSA-N
SMILES
c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)C(=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: 4F3X
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Color Legend
Unassigned regionsLigand / hetero atomse4f3xA1e4f3xA2e4f3xB1e4f3xB2e4f3xC1e4f3xC2e4f3xD1e4f3xD2
ECOD domains from experimental PDB structures interacting with ligand DB14128
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q92ND9DB14128NAD4f3xe4f3xA1A:0-248
Q92ND9DB14128NAD4f3xe4f3xA2A:249-475
Q92ND9DB14128NAD4f3xe4f3xB1B:0-248
Q92ND9DB14128NAD4f3xe4f3xB2B:249-475
Q92ND9DB14128NAD4f3xe4f3xC1C:0-248
Q92ND9DB14128NAD4f3xe4f3xC2C:249-475
Q92ND9DB14128NAD4f3xe4f3xD1D:249-475
Q92ND9DB14128NAD4f3xe4f3xD2D:1-248