Ligand name: 1-(3,4-dichlorobenzyl)-3,7-dimethyl-8-morpholin-4-yl-3,7-dihydro-1H-purine-2,6-dione
PDB ligand accession: 1AZ
DrugBank: n/a
PubChem: 657868
ChEMBL: CHEMBL1229712
InChI Key: BFRVAZYYGGLHQS-UHFFFAOYSA-N
SMILES: Cn1c2c(nc1N3CCOCC3)N(C(=O)N(C2=O)Cc4ccc(c(c4)Cl)Cl)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 P0A590

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2WGS	Download	Experimental	e2wgsA1 e2wgsB1 e2wgsC1 e2wgsD1 e2wgsE1 e2wgsF1 e2wgsG1 e2wgsH1 e2wgsI1 e2wgsJ1 e2wgsK1 e2wgsL1	Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like	LigPlot
2WHI	Download	Experimental	e2whiA1 e2whiB1 e2whiC1 e2whiD1 e2whiE1 e2whiF1	Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like Glutamine synthetase-like	LigPlot