Ligand name: 5'-{[(3-aminopropyl)sulfonyl]amino}-5'-deoxyadenosine
PDB ligand accession: VMX
DrugBank: n/a
PubChem: 49867821
ChEMBL: n/a
InChI Key: GCNSCCULRVBOML-QYVSTXNMSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CNS(=O)(=O)CCCN)O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: 5'-deoxyribonucleosides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9UBT2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3KYD	Download	Experimental	e3kydD1 e3kydB1 e3kydB3	beta-Grasp Rossmann-like Catalytic cysteine domain in ubiquitin-activating enzyme	LigPlot