Ligand name: 1,1'-PROPANE-1,3-DIYLBIS(3,7-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE)
PDB ligand accession: DW0
DrugBank: n/a
PubChem: 5025063
ChEMBL: CHEMBL1738791
InChI Key: KEPIKAFUZRKZMT-UHFFFAOYSA-N
SMILES: Cn1cnc2c1C(=O)N(C(=O)N2C)CCCN3C(=O)c4c(ncn4C)N(C3=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein Q9BZP6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2YBT	Download	Experimental	e2ybtA1 e2ybtA2 e2ybtD2 e2ybtB1 e2ybtB2 e2ybtF2 e2ybtC1 e2ybtC2 e2ybtA2 e2ybtD1 e2ybtD2 e2ybtE1 e2ybtE2 e2ybtB2 e2ybtF1 e2ybtF2	FKBP-like TIM beta/alpha-barrel TIM beta/alpha-barrel FKBP-like TIM beta/alpha-barrel TIM beta/alpha-barrel FKBP-like TIM beta/alpha-barrel TIM beta/alpha-barrel FKBP-like TIM beta/alpha-barrel FKBP-like TIM beta/alpha-barrel TIM beta/alpha-barrel FKBP-like TIM beta/alpha-barrel	LigPlot