Ligand name: S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] (9Z)-hexadec-9-enethioate
PDB ligand accession: ZMQ
DrugBank: n/a
PubChem: 24941267
ChEMBL: n/a
InChI Key: IKLUIZJWBLJHAQ-HAAQQRBASA-N
SMILES: CCCCCCC=CCCCCCCCC(=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 P53554

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3EJD	Download	Experimental	e3ejdB1 e3ejdA1 e3ejdD1 e3ejdC1 e3ejdF1 e3ejdE1 e3ejdH1 e3ejdG1	Cytochrome P450 ACP-like Cytochrome P450 ACP-like Cytochrome P450 ACP-like Cytochrome P450 ACP-like	LigPlot