Attributes
UniProt ID
Protein Name
Citrate synthase
Ligand Name
s-citryldethia Coenzyme A
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JCKIRWYQPYQCEC-LWCHDFGBSA-N
SMILES
CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(NCCC(=O)NCCCC(=O)CC(CC(=O)O)(C(=O)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: 2R9E
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Color Legend
Unassigned regionsLigand / hetero atomse2r9eA1e2r9eB1e2r9eC1e2r9eD1