Ligand name: Acetoacetyl-CoA
PDB ligand accession: CAA
DrugBank: DB03059
InChI Key: OJFDKHTZOUZBOS-CITAKDKDSA-N
SMILES: CC(=O)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 P16219

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
P16219	Download	Predicted	P16219_F1_nD2 P16219_F1_nD1 P16219_F1_nD3	Acyl-CoA dehydrogenase middle domain-like Acyl-CoA dehydrogenase N-terminal domain-like Bromodomain-like
2VIG		Predicted	e2vigA1 e2vigB1 e2vigC1 e2vigD1 e2vigE1 e2vigF1 e2vigG1 e2vigH1 e2vigA2 e2vigB2 e2vigC2 e2vigD2 e2vigE2 e2vigF2 e2vigG2 e2vigH2 e2vigA3 e2vigB3 e2vigC3 e2vigD3 e2vigE3 e2vigF3 e2vigG3 e2vigH3