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Attributes

UniProt ID
P16544
Protein Name
Putative ketoacyl reductase
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

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Mol*
Structure: 1X7H
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Color Legend
Unassigned regionsLigand / hetero atomse1x7hA1e1x7hB1
ECOD domains from experimental PDB structures interacting with ligand DB02338
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P16544DB02338NDP1x7he1x7hA1A:6-261
P16544DB02338NDP1x7he1x7hB1B:5-261
P16544DB02338NDP2rh4e2rh4A1A:5-261
P16544DB02338NDP2rh4e2rh4B1B:5-261
P16544DB02338NDP2rhre2rhrA1A:6-261
P16544DB02338NDP2rhre2rhrB1B:-2-261
P16544DB02338NDP3csde3csdA1A:6-261
P16544DB02338NDP3csde3csdB1B:-3-261
P16544DB02338NDP3qrwe3qrwA1A:5-261
P16544DB02338NDP3qrwe3qrwB1B:1-261
P16544DB02338NDP3ri3e3ri3A1A:6-261
P16544DB02338NDP3ri3e3ri3B1B:-3-261
P16544DB02338NDP4dbze4dbzA2A:5-261
P16544DB02338NDP4dbze4dbzB1B:1-261
P16544DB02338NDP4dc0e4dc0A2A:4-261
P16544DB02338NDP4dc0e4dc0B2B:1-261
P16544DB02338NDP4dc1e4dc1A2A:4-261
P16544DB02338NDP4dc1e4dc1B2B:1-261