Ligand name: S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] hexadecanethioate
PDB ligand accession: G9S
DrugBank: n/a
PubChem: 137628300
ChEMBL: n/a
InChI Key: JSWBEHRITPIXLC-RUZDIDTESA-N
SMILES: CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein B7MJ81

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6DFL	Download	Experimental	e6dflA1 e6dflB1	Protein kinase/SAICAR synthase/ATP-grasp ACP-like	LigPlot