Ligand name: COENZYME A
PDB ligand accession: COA
DrugBank: DB01992
PubChem: 87642
ChEMBL: CHEMBL1213327
InChI Key: RGJOEKWQDUBAIZ-IBOSZNHHSA-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)NCCS)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q3V1Y3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2H3U	Download	Experimental	e2h3uA1 e2h3uA2 e2h3uB1 e2h3uB2	CoA-dependent acyltransferases CoA-dependent acyltransferases CoA-dependent acyltransferases CoA-dependent acyltransferases	LigPlot
2H3P	Download	Experimental	e2h3pA1 e2h3pA2	CoA-dependent acyltransferases CoA-dependent acyltransferases	LigPlot
2H3W	Download	Experimental	e2h3wA1 e2h3wA2 e2h3wB1 e2h3wB2	CoA-dependent acyltransferases CoA-dependent acyltransferases CoA-dependent acyltransferases CoA-dependent acyltransferases	LigPlot