Attributes
UniProt ID
Protein Name
Enoyl-CoA hydratase/carnithine racemase
Ligand Name
~{S}-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] 2-(2,5-dihydrooxepin-7-yl)ethanethioate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GQJGZLQATBGDEV-CECATXLMSA-N
SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC4=CCC=CCO4)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6SLA
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Color Legend
Unassigned regionsLigand / hetero atomse6slaAAA1e6slaBBB1e6slaCCC1e6slaDDD1e6slaEEE1e6slaFFF1
ECOD domains from experimental PDB structures interacting with ligand LHQ