DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
2-oxoglutarate dehydrogenase E1/E2 component
Ligand Name
ACETYL COENZYME *A
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZSLZBFCDCINBPY-ZSJPKINUSA-N
SMILES
CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 8P5S
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Color Legend
Unassigned regionsLigand / hetero atomse8p5sA1e8p5sA2e8p5sA3e8p5sA4
ECOD domains from experimental PDB structures interacting with ligand ACO
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8NRC3n/aACO8p5se8p5sA1A:815-1088
Q8NRC3n/aACO8p5se8p5sA3A:1089-1220
Q8NRC3n/aACO8p5te8p5tA1A:1089-1220
Q8NRC3n/aACO8p5te8p5tA4A:822-1088
Q8NRC3n/aACO8p5te8p5tB1B:1089-1220
Q8NRC3n/aACO8p5te8p5tB3B:822-1088
Q8NRC3n/aACO8p5te8p5tC2C:1089-1220
Q8NRC3n/aACO8p5te8p5tC3C:822-1088
Q8NRC3n/aACO8p5te8p5tD2D:1089-1220
Q8NRC3n/aACO8p5te8p5tD4D:822-1088
Q8NRC3n/aACO8p5te8p5tE2E:822-1088
Q8NRC3n/aACO8p5te8p5tE3E:1089-1220
Q8NRC3n/aACO8p5te8p5tF1F:1089-1220
Q8NRC3n/aACO8p5te8p5tF4F:822-1088
Q8NRC3n/aACO8p5ue8p5uA2A:822-1088
Q8NRC3n/aACO8p5ue8p5uA3A:1089-1220
Q8NRC3n/aACO8p5ue8p5uB1B:1089-1220
Q8NRC3n/aACO8p5ue8p5uB4B:822-1088
Q8NRC3n/aACO8p5ue8p5uC1C:822-1088
Q8NRC3n/aACO8p5ue8p5uC4C:1089-1220
Q8NRC3n/aACO8p5ue8p5uD1D:822-1088
Q8NRC3n/aACO8p5ue8p5uD3D:1089-1220
Q8NRC3n/aACO8p5ue8p5uE2E:1089-1220
Q8NRC3n/aACO8p5ue8p5uE4E:822-1088
Q8NRC3n/aACO8p5ue8p5uF3F:1089-1220
Q8NRC3n/aACO8p5ue8p5uF4F:822-1088
Q8NRC3n/aACO8p5ve8p5vA2A:821-1088
Q8NRC3n/aACO8p5ve8p5vA4A:1089-1220
Q8NRC3n/aACO8p5ve8p5vB3B:821-1088
Q8NRC3n/aACO8p5ve8p5vB4B:1089-1220
Q8NRC3n/aACO8p5ve8p5vC2C:1089-1220
Q8NRC3n/aACO8p5ve8p5vC4C:821-1088
Q8NRC3n/aACO8p5ve8p5vD2D:821-1088
Q8NRC3n/aACO8p5ve8p5vD4D:1089-1220
Q8NRC3n/aACO8p5ve8p5vE1E:821-1088
Q8NRC3n/aACO8p5ve8p5vE2E:1089-1220
Q8NRC3n/aACO8p5ve8p5vF1F:821-1088
Q8NRC3n/aACO8p5ve8p5vF3F:1089-1220
Q8NRC3n/aACO8p5we8p5wA1A:822-1088
Q8NRC3n/aACO8p5we8p5wA3A:1089-1220
Q8NRC3n/aACO8p5we8p5wB2B:822-1088
Q8NRC3n/aACO8p5we8p5wB3B:1089-1220
Q8NRC3n/aACO8p5we8p5wC3C:822-1088
Q8NRC3n/aACO8p5we8p5wC4C:1089-1220
Q8NRC3n/aACO8p5we8p5wD2D:822-1088
Q8NRC3n/aACO8p5we8p5wD3D:1089-1220
Q8NRC3n/aACO8p5we8p5wE3E:1089-1220
Q8NRC3n/aACO8p5we8p5wE4E:822-1088
Q8NRC3n/aACO8p5we8p5wF1F:1089-1220
Q8NRC3n/aACO8p5we8p5wF4F:822-1088