Ligand name: 6-chloro-9H-purine
PDB ligand accession: ES4
DrugBank: n/a
PubChem: 6886;5359277;
ChEMBL: CHEMBL140037
InChI Key: ZKBQDFAWXLTYKS-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)c(ncn2)Cl
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 Q9I6Y4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PBM	Download	Experimental	e3pbmA1 e3pbmB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot