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 W1Q6W1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5LQY	Download	Experimental	e5lqyB2 e5lqyB3 e5lqyE1 e5lqyE3 e5lqyC1 e5lqyC3 e5lqyF1 e5lqyF3 e5lqyC3 e5lqyD1 e5lqyD3 e5lqyB2 e5lqyF1 e5lqyF3	P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like	LigPlot
5LQX	Download	Experimental	e5lqxB1 e5lqxB2 e5lqxE2 e5lqxC1 e5lqxC3 e5lqxF2 e5lqxF3 e5lqxC3 e5lqxD1 e5lqxD3 e5lqxB2 e5lqxF2 e5lqxF3	C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase	LigPlot
5LQZ	Download	Experimental	e5lqzB2 e5lqzB3 e5lqzE1 e5lqzE3 e5lqzC2 e5lqzC3 e5lqzF1 e5lqzF2 e5lqzC2 e5lqzD2 e5lqzD3 e5lqzB3 e5lqzF1 e5lqzF2	C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like P-loop domains-like C-terminal domain of alpha and beta subunits of F1 ATP synthase P-loop domains-like	LigPlot