DrugDomain logoDrugDomain

Attributes

UniProt ID
Q8N4T8
Protein Name
3-oxoacyl- reductase
Ligand Name
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
DB03461
PDB Ligand Accession
NAP
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XJLXINKUBYWONI-NNYOXOHSSA-N
SMILES
c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)OP(=O)(O)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: 4CQM
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Color Legend
Unassigned regionsLigand / hetero atomse4cqmA1e4cqmB1e4cqmC1e4cqmD1e4cqmE1e4cqmF1e4cqmG1e4cqmH1e4cqmI1e4cqmJ1e4cqmK1e4cqmL1e4cqmM1e4cqmN1e4cqmO1e4cqmP1
ECOD domains from experimental PDB structures interacting with ligand DB03461
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8N4T8DB03461NAP4cqme4cqmB1B:1-237
Q8N4T8DB03461NAP4cqme4cqmC1C:3-237
Q8N4T8DB03461NAP4cqme4cqmF1F:1-237
Q8N4T8DB03461NAP4cqme4cqmG1G:5-237
Q8N4T8DB03461NAP4cqme4cqmJ1J:1-237
Q8N4T8DB03461NAP4cqme4cqmK1K:1-237
Q8N4T8DB03461NAP4cqme4cqmN1N:1-237
Q8N4T8DB03461NAP4cqme4cqmO1O:1-237