Attributes
UniProt ID
Protein Name
2-hydroxyisocaproyl-CoA dehydratase alpha subunit
Ligand Name
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl ]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethyl] (2R)-2-hydroxy-4-methyl-pentanethioate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CFNPCSNXESBNGR-LYALRYAQSA-N
SMILES
CC(C)CC(C(=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)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3O3N
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Color Legend
Unassigned regionsLigand / hetero atomse3o3nA1e3o3nA2e3o3nB1e3o3nB2e3o3nC1e3o3nC2e3o3nD1e3o3nD2