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Attributes

UniProt ID
Protein Name
Putative 2,5-diketo-D-gluconic acid reductase
Ligand Name
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
PDB Ligand Accession
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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Structure: 3WBW
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Color Legend
Unassigned regionsLigand / hetero atomse3wbwA1e3wbwB1
ECOD domains from experimental PDB structures interacting with ligand DB02338
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q5FT75DB02338NDP3wbwe3wbwA1A:9-279
Q5FT75DB02338NDP3wbwe3wbwB1B:9-279
Q5FT75DB02338NDP3wbye3wbyA1A:9-279
Q5FT75DB02338NDP3wbye3wbyB1B:9-279