Ligand name: ethyl 3,4,5-trihydroxybenzoate
PDB ligand accession: EGR
DrugBank: n/a
PubChem: 13250
ChEMBL: CHEMBL453196
InChI Key: VFPFQHQNJCMNBZ-UHFFFAOYSA-N
SMILES: CCOC(=O)c1cc(c(c(c1)O)O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein B3Y018

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4J0K	Download	Experimental	e4j0kA1 e4j0kB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
4JUI	Download	Experimental	e4juiA1 e4juiB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot