Ligand name: CROTONYL COENZYME A
PDB ligand accession: COO
DrugBank: n/a
PubChem: 92856
ChEMBL: n/a
InChI Key: KFWWCMJSYSSPSK-XBTRWLRFSA-N
SMILES: CC=CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)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 B7TVP1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3GF3	Download	Experimental	e3gf3A5	ClpP/crotonase	LigPlot
3GLM	Download	Experimental	e3glmC6 e3glmA5 e3glmA6 e3glmB5 e3glmD6 e3glmC5 e3glmA5 e3glmA6 e3glmB6 e3glmD5	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot