Ligand name: 4,4'-propane-2,2-diylbis(2,6-dibromophenol)
PDB ligand accession: XDI
DrugBank: n/a
PubChem: 6618
ChEMBL: CHEMBL184450
InChI Key: VEORPZCZECFIRK-UHFFFAOYSA-N
SMILES: CC(C)(c1cc(c(c(c1)Br)O)Br)c2cc(c(c(c2)Br)O)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Diphenylmethanes

List of PDB structures and/or AlphaFold models with target protein Q9PTT3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6GNO	Download	Experimental	e6gnoA1 e6gnoB1	Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich	LigPlot