Ligand name: [(2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHYL[HYDROXY-[[(2R,3S,4R,5S)-3,4,5-TRIHYDROXYOXOLAN-2-YL]METHOXY]PHOSPHORYL] HYDROGEN PHOSPHATE
PDB ligand accession: AR6
DrugBank: DB02059
PubChem: 447048
ChEMBL: n/a
InChI Key: SRNWOUGRCWSEMX-ZQSHOCFMSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)O)O)O)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleotides
      • Subclass: Purine nucleotide sugars

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q9NTG7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4BN4	Download	Experimental	e4bn4A1	Rossmann-like	LigPlot
4BVB	Download	Experimental	e4bvbA1	Rossmann-like	LigPlot
4BVH	Download	Experimental	e4bvhB1	Rossmann-like	LigPlot