Ligand name: ADENOSINE-5'-DIPHOSPHATE
PDB ligand accession: ADP
DrugBank: DB16833
PubChem: 6022
ChEMBL: CHEMBL14830
InChI Key: XTWYTFMLZFPYCI-KQYNXXCUSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=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 ribonucleotides

List of PDB structures and/or AlphaFold models with target protein Q288C4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7WBT	Download	Experimental	e7wbtA2 e7wbtA3 e7wbtA4 e7wbtB2 e7wbtB3 e7wbtB4	P-loop domains-like Histone-like NLRC4 helical domain HD2 P-loop domains-like Histone-like NLRC4 helical domain HD2	LigPlot
7WBU	Download	Experimental	e7wbuA2 e7wbuA3 e7wbuA4	P-loop domains-like Histone-like NLRC4 helical domain HD2	LigPlot