Ligand name: 2-amino-1,9-dihydro-6H-purine-6-thione
PDB ligand accession: DX4
DrugBank: DB00352
PubChem: 1537;2723601;
ChEMBL: CHEMBL727
InChI Key: WYWHKKSPHMUBEB-UHFFFAOYSA-N
SMILES: c1[nH]c2c(n1)C(=S)NC(=N2)N
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 Q581W1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3JQA	Download	Experimental	e3jqaA1 e3jqaB1 e3jqaC1 e3jqaD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot