Ligand name: methyl 7-{[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-7-oxoheptanoate
PDB ligand accession: ZMK
DrugBank: n/a
PubChem: 60210965
ChEMBL: n/a
InChI Key: HCFLUHFHCAMJNF-QGZVFWFLSA-N
SMILES: CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CCCCCC(=O)OC)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 Q0T5U2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4ETW	Download	Experimental	e4etwC2 e4etwD1 e4etwA1 e4etwB1	alpha/beta-Hydrolases ACP-like alpha/beta-Hydrolases ACP-like	LigPlot