Ligand name: (2R)-3-(3,4-dihydroxyphenyl)-2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}propanoic acid
PDB ligand accession: ROA
DrugBank: DB16865
PubChem: 5281792
ChEMBL: CHEMBL324842
InChI Key: DOUMFZQKYFQNTF-WUTVXBCWSA-N
SMILES: c1cc(c(cc1CC(C(=O)O)OC(=O)C=Cc2ccc(c(c2)O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Cinnamic acids and derivatives
      • Subclass: Hydroxycinnamic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P58399

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3QNL	Download	Experimental	e3qnlA1 e3qnlB1	Phospholipase A2, PLA2 Phospholipase A2, PLA2	LigPlot