DrugDomain logoDrugDomain

Attributes

UniProt ID
P52209
Protein Name
6-phosphogluconate dehydrogenase, decarboxylating
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: 2JKV
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Color Legend
Unassigned regionsLigand / hetero atomse2jkvA1e2jkvA2e2jkvB1e2jkvB2e2jkvC1e2jkvC2e2jkvD1e2jkvD2e2jkvE1e2jkvE2e2jkvF1e2jkvF2
ECOD domains from experimental PDB structures interacting with ligand DB03461
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P52209DB03461NAP2jkve2jkvA1A:178-483
P52209DB03461NAP2jkve2jkvA2A:2-177
P52209DB03461NAP2jkve2jkvB1B:178-483
P52209DB03461NAP2jkve2jkvB2B:2-177
P52209DB03461NAP2jkve2jkvC1C:178-483
P52209DB03461NAP2jkve2jkvC2C:2-177
P52209DB03461NAP2jkve2jkvD1D:178-483
P52209DB03461NAP2jkve2jkvD2D:2-177
P52209DB03461NAP2jkve2jkvE1E:178-483
P52209DB03461NAP2jkve2jkvE2E:2-177
P52209DB03461NAP2jkve2jkvF1F:178-472
P52209DB03461NAP2jkve2jkvF2F:2-177