Ligand name: 4-HYDROXYBENZOYL COENZYME A
PDB ligand accession: BCA
DrugBank: DB01652
PubChem: 168718
ChEMBL: n/a
InChI Key: LTVXPVBFJBTNIJ-TYHXJLICSA-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)c4ccc(cc4)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Fatty Acyls
      • Subclass: Fatty acyl thioesters

List of PDB structures and/or AlphaFold models with target protein A5JTM5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1JXZ	Download	Experimental	e1jxzA1 e1jxzB1 e1jxzB1 e1jxzC1 e1jxzA1 e1jxzC1	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot
1NZY	Download	Experimental	e1nzyA1 e1nzyB1 e1nzyB1 e1nzyC1 e1nzyA1 e1nzyC1	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot