Ligand name: 2-oxopentadecyl-CoA
PDB ligand accession: NHW
DrugBank: n/a
PubChem: 72199467
ChEMBL: n/a
InChI Key: JKWHUJMJVNMKEF-UOCZADIYSA-J
SMILES: CCCCCCCCCCCCCC(=O)CSCCNC(=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: S-alkyl-CoAs
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein A4I7H1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2WUU	Download	Experimental	e2wuuA1 e2wuuA2	Nat/Ivy Nat/Ivy	LigPlot