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 P12612

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7YLY	Download	Experimental	e7ylyA1 e7ylyA2 e7ylya1 e7ylya3	Zincin-like GroEL equatorial domain-like GroEL equatorial domain-like Zincin-like	LigPlot
4V8R	Download	Experimental	e4v8rAA1 e4v8rAA3 e4v8rAa1 e4v8rAa3 e4v8rBA1 e4v8rBA3 e4v8rBa1 e4v8rBa3	GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like	LigPlot
6KS6	Download	Experimental	e6ks6a2 e6ks6a3 e6ks6A1 e6ks6A3	GroEL equatorial domain-like Zincin-like Zincin-like GroEL equatorial domain-like	LigPlot
7YLX	Download	Experimental	e7ylxA2 e7ylxA3 e7ylxa1 e7ylxa2	Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like	LigPlot
7YLW	Download	Experimental	e7ylwA2 e7ylwA3 e7ylwa1 e7ylwa2	Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like	LigPlot
4V94	Download	Experimental	e4v94A1 e4v94A3 e4v94I1 e4v94I3 e4v94a1 e4v94a3 e4v94i1 e4v94i3	GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like	LigPlot
4V81	Download	Experimental	e4v81A2 e4v81A3 e4v81a2 e4v81a3	Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like	LigPlot