Ligand name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoic acid
PDB ligand accession: BXS
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: PXVGKLGOADHWIZ-TWGQIWQCSA-N
SMILES: c1cc2c(cc1C(=O)C=C(C(=O)O)O)OCCO2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodioxanes
      • Subclass: Benzo-1,4-dioxanes

List of PDB structures and/or AlphaFold models with target protein A5U3K4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6AU9	Download	Experimental	e6au9A1	TIM beta/alpha-barrel	LigPlot