Ligand name: Phomopsin A
PDB ligand accession: HOS
DrugBank: n/a
PubChem: 6438581
ChEMBL: CHEMBL446991
InChI Key: FAFRRYBYQKPKSY-AJSRVUJESA-N
SMILES: CCC(=C(C(=O)NC(=CC(=O)O)C(=O)O)NC(=O)C1C=CCN1C(=O)C2C(Oc3cc(cc(c3O)Cl)C(C(C(=O)NC(C(=O)N2)C(=C)C)NC)O)(C)CC)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein A0A287AGU7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7CNO	Download	Experimental	e7cnoC2 e7cnoB1 e7cnoB2 e7cnoD1	Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like	LigPlot