Ligand name: S-[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] dodecanethioate
PDB ligand accession: 8Q1
DrugBank: n/a
PubChem: 119058169
ChEMBL: n/a
InChI Key: MVHUOSAYFQKAMT-NRFANRHFSA-N
SMILES: CCCCCCCCCCCC(=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: Organic phosphoric acids and derivatives
      • Subclass: Phosphate esters

List of PDB structures and/or AlphaFold models with target protein P53665

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7AQW	Download	Experimental	e7aqwT1 e7aqwn1	ACP-like LYR protein	LigPlot
7ARB	Download	Experimental	e7arbT1 e7arbn1	ACP-like LYR protein	LigPlot
8BQ5	Download	Experimental	e8bq5T1	ACP-like	LigPlot
7AR8	Download	Experimental	e7ar8L1 e7ar8T1 e7ar8n1	Sodium/proton antiporter subunits-like ACP-like LYR protein	LigPlot
7AR7	Download	Experimental	e7ar7L1 e7ar7T1 e7ar7n1	Sodium/proton antiporter subunits-like ACP-like LYR protein	LigPlot
8BQ6	Download	Experimental	e8bq6T1	ACP-like	LigPlot
8BPX	Download	Experimental	e8bpxT1	ACP-like	LigPlot
8BEH	Download	Experimental	e8behL1 e8behT1	Sodium/proton antiporter subunits-like ACP-like	LigPlot