Ligand name: preaustinoid A2
PDB ligand accession: 8T0
DrugBank: n/a
PubChem: 132274399
ChEMBL: CHEMBL4519119
InChI Key: SGTJQTPUMKGFFZ-RFMSQVAGSA-N
SMILES: CC1(C2CCC3(C(C2(C=CC(=O)O1)C)CC4(C(=C)C3(C(=O)C(C4=O)(C)O)C(=O)OC)C)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Dicarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein A0A1E1FFL0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5YBQ	Download	Experimental	e5ybqA1 e5ybqA1 e5ybqB1	jelly-roll jelly-roll jelly-roll	LigPlot