Ligand name: 2-(3,6-DIHYDROXYPHENYL)ACETIC ACID
PDB ligand accession: OMD
DrugBank: DB08327
PubChem: 780
ChEMBL: n/a
InChI Key: IGMNYECMUMZDDF-UHFFFAOYSA-N
SMILES: c1cc(c(cc1O)CC(=O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Phenylacetic acids

List of PDB structures and/or AlphaFold models with target protein Q88E47

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4AQ6	Download	Experimental	e4aq6A3 e4aq6B3 e4aq6C3 e4aq6D3 e4aq6E3 e4aq6F3 e4aq6G3 e4aq6H3 e4aq6I3 e4aq6J3 e4aq6K3 e4aq6L3	jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot
3ZDS	Download	Experimental	e3zdsB3 e3zdsD3 e3zdsE3 e3zdsG3 e3zdsH3 e3zdsI3 e3zdsJ3 e3zdsK3	jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot