DrugDomain logoDrugDomain

Attributes

UniProt ID
A0QP46
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: 6CI9
Open File
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse6ci9A1e6ci9B1e6ci9C1e6ci9D1e6ci9E1e6ci9F1e6ci9G1e6ci9H1e6ci9I1e6ci9J1e6ci9K1e6ci9L1e6ci9M1e6ci9N1e6ci9O1e6ci9P1
ECOD domains from experimental PDB structures interacting with ligand DB03461
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
A0QP46DB03461NAP6ci9e6ci9A1A:-1-254
A0QP46DB03461NAP6ci9e6ci9B1B:0-254
A0QP46DB03461NAP6ci9e6ci9C1C:-1-256
A0QP46DB03461NAP6ci9e6ci9D1D:-1-257
A0QP46DB03461NAP6ci9e6ci9E1E:-1-253
A0QP46DB03461NAP6ci9e6ci9F1F:0-253
A0QP46DB03461NAP6ci9e6ci9G1G:-1-254
A0QP46DB03461NAP6ci9e6ci9H1H:0-252
A0QP46DB03461NAP6ci9e6ci9I1I:0-257
A0QP46DB03461NAP6ci9e6ci9J1J:0-256
A0QP46DB03461NAP6ci9e6ci9K1K:-1-253
A0QP46DB03461NAP6ci9e6ci9L1L:0-252
A0QP46DB03461NAP6ci9e6ci9M1M:-1-254
A0QP46DB03461NAP6ci9e6ci9N1N:0-253
A0QP46DB03461NAP6ci9e6ci9O1O:1-253
A0QP46DB03461NAP6ci9e6ci9P1P:-1-253