Ligand name: 2-[(2-amino-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-methylacetamide
PDB ligand accession: 7PS
DrugBank: n/a
PubChem: 127050032;135567307;
ChEMBL: CHEMBL3819615
InChI Key: MKEVUZQIEYSSFO-UHFFFAOYSA-N
SMILES: CNC(=O)CSc1[nH]c2c(n1)C(=O)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 P0AC14

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5U11	Download	Experimental	e5u11A1 e5u11B1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot