Ligand name: Salicylyl CoA
PDB ligand accession: 2NE
DrugBank: n/a
PubChem: 11966295
ChEMBL: n/a
InChI Key: YTKKDFTVSNSVEE-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)c4ccccc4O)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 P9WNP5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4QII	Download	Experimental	e4qiiA1 e4qiiF1 e4qiiG1 e4qiiB1 e4qiiE1 e4qiiI1 e4qiiC1 e4qiiD1 e4qiiH1 e4qiiC1 e4qiiD1 e4qiiB1 e4qiiE1 e4qiiA1 e4qiiF1 e4qiiA1 e4qiiG1 e4qiiL1 e4qiiC1 e4qiiH1 e4qiiK1 e4qiiB1 e4qiiI1 e4qiiJ1 e4qiiI1 e4qiiJ1 e4qiiH1 e4qiiK1 e4qiiG1 e4qiiL1	ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase	LigPlot