Ligand name: PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER
PDB ligand accession: AGS
DrugBank: DB02930
PubChem: 440317;444377;
ChEMBL: CHEMBL131890
InChI Key: NLTUCYMLOPLUHL-KQYNXXCUSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=S)(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 ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q9FD73

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4DPW	Download	Experimental	e4dpwA5 e4dpwA6 e4dpwB5 e4dpwB6 e4dpwC5 e4dpwC6 e4dpwD5 e4dpwD6 e4dpwE5 e4dpwE6 e4dpwF5 e4dpwF6 e4dpwG5 e4dpwG6 e4dpwH5 e4dpwH6	Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits	LigPlot
4DPT	Download	Experimental	e4dptB5 e4dptB6	Ribosomal protein S5 domain 2-like Alpha-beta plaits	LigPlot
4DPU	Download	Experimental	e4dpuB6 e4dpuA5 e4dpuA6 e4dpuB5 e4dpuB6	Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits Ribosomal protein S5 domain 2-like Alpha-beta plaits	LigPlot