Ligand name: [(2~{R},3~{S},4~{R},5~{R})-5-(6-azanyl-2-pyridin-3-yl-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(2~{S})-2-azanyl-3-oxidanyl-propanoyl]sulfamate
PDB ligand accession: JPE
DrugBank: n/a
PubChem: 145829192
ChEMBL: CHEMBL4561900
InChI Key: AJLUWRJYNKUFKX-OBXKABKQSA-N
SMILES: c1cc(cnc1)c2nc(c3c(n2)n(cn3)C4C(C(C(O4)COS(=O)(=O)NC(=O)C(CO)N)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Purine nucleosides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein A0A1X3JK72

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6R1O	Download	Experimental	e6r1oA1	Class II aaRS and biotin synthetases	LigPlot