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 P24752

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2IBW	Download	Experimental	e2ibwA1 e2ibwA2 e2ibwC1 e2ibwB1 e2ibwB2 e2ibwD1 e2ibwA1 e2ibwA2 e2ibwC1 e2ibwC2 e2ibwB1 e2ibwD1 e2ibwD2	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot
2IBU	Download	Experimental	e2ibuA1 e2ibuA2 e2ibuC1 e2ibuB1 e2ibuB2 e2ibuD1 e2ibuA1 e2ibuA2 e2ibuC1 e2ibuC2 e2ibuB1 e2ibuD1 e2ibuD2	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot
2F2S	Download	Experimental	e2f2sA1 e2f2sA2 e2f2sB1 e2f2sB2 e2f2sC1 e2f2sC2 e2f2sD1 e2f2sD2	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot
2IBY	Download	Experimental	e2ibyA1 e2ibyA2 e2ibyC1 e2ibyB1 e2ibyB2 e2ibyD1 e2ibyA1 e2ibyA2 e2ibyC1 e2ibyC2 e2ibyB1 e2ibyD1 e2ibyD2	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot