Ligand name: (3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl 2,2-dimethylpropanoate
PDB ligand accession: PN5
DrugBank: DB08408
PubChem: 25011727
ChEMBL: n/a
InChI Key: KVQSHCZSRKQWCB-LBPRGKRZSA-N
SMILES: CC(C)(C)C(=O)OCC(C)(C)C(C(=O)NCCC(=O)NCCS)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 P07097

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2VU2	Download	Experimental	e2vu2A1 e2vu2A2 e2vu2D1 e2vu2B1 e2vu2B2 e2vu2C1	Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like Thiolase-like	LigPlot