Ligand name: 3-(cyclohexylmethyl)-6,8-bis(oxidanyl)isochromen-1-one
PDB ligand accession: D5O
DrugBank: n/a
PubChem: 146018252
ChEMBL: n/a
InChI Key: ZYQPLLMXINVPHW-UHFFFAOYSA-N
SMILES: c1c(cc(c2c1C=C(OC2=O)CC3CCCCC3)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Isocoumarins and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein W7JP72

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6KCT	Download	Experimental	e6kctA2 e6kctB1 e6kctC1 e6kctD1	Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases	LigPlot