Ligand name: ethyl (3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetate
PDB ligand accession: XXL
DrugBank: n/a
PubChem: 3155598
ChEMBL: n/a
InChI Key: PNKJMWWGWBCNQL-UHFFFAOYSA-N
SMILES: CCOC(=O)CN1c2ccccc2OCC1=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 Q4Q5S8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5AG7	Download	Experimental	e5ag7A1 e5ag7A2	Nat/Ivy Nat/Ivy	LigPlot