Ligand name: 2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID 2-CHLORO-6-FLUORO-BENZYLAMIDE (2-HYDROXY-INDAN-1- YL)-AMIDE
PDB ligand accession: MSC
DrugBank: n/a
PubChem: 444975
ChEMBL: n/a
InChI Key: BVPTXJDSYPTXMO-VQEIZDKSSA-N
SMILES: c1ccc(cc1)COC(C(C(C(C(=O)NC2c3ccccc3CC2O)OCc4ccccc4)O)O)C(=O)NCc5c(cccc5Cl)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Indanes
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1D4J	Download	Experimental	e1d4jB1 e1d4jA1	cradle loop barrel cradle loop barrel	LigPlot