Ligand name: ADENOSINE-3'-5'-DIPHOSPHATE
PDB ligand accession: A3P
DrugBank: DB01812
PubChem: 159296
ChEMBL: CHEMBL574817
InChI Key: WHTCPDAXWFLDIH-KQYNXXCUSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)O)OP(=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 drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P50225

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4GRA	Download	Experimental	e4graA1 e4graB1	P-loop domains-like P-loop domains-like	LigPlot
2D06	Download	Experimental	e2d06A1 e2d06B1	P-loop domains-like P-loop domains-like	LigPlot
3U3O	Download	Experimental	e3u3oA1	P-loop domains-like	LigPlot
3QVV	Download	Experimental	e3qvvA1 e3qvvB1	P-loop domains-like P-loop domains-like	LigPlot
3U3K	Download	Experimental	e3u3kA1 e3u3kB1	P-loop domains-like P-loop domains-like	LigPlot
3U3J	Download	Experimental	e3u3jA1 e3u3jB1	P-loop domains-like P-loop domains-like	LigPlot
1Z28	Download	Experimental	e1z28A1	P-loop domains-like	LigPlot
1LS6	Download	Experimental	e1ls6A1	P-loop domains-like	LigPlot
3QVU	Download	Experimental	e3qvuA1 e3qvuB1	P-loop domains-like P-loop domains-like	LigPlot
3U3R	Download	Experimental	e3u3rA1	P-loop domains-like	LigPlot
3U3M	Download	Experimental	e3u3mA1	P-loop domains-like	LigPlot