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 Q01853

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1S3S	Download	Experimental	e1s3sA5 e1s3sA7 e1s3sE5 e1s3sE7 e1s3sF5 e1s3sB2 e1s3sB4 e1s3sD5 e1s3sC5 e1s3sC7 e1s3sD5 e1s3sD7 e1s3sB2 e1s3sC5 e1s3sE5 e1s3sE7 e1s3sF5 e1s3sF7 e1s3sA5 e1s3sA7	P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like	LigPlot
3CF3	Download	Experimental	e3cf3A19 e3cf3A21 e3cf3B19 e3cf3B21 e3cf3C19 e3cf3C21	P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like	LigPlot
3CF1	Download	Experimental	e3cf1A7 e3cf1A10 e3cf1A7 e3cf1A10 e3cf1B19 e3cf1B21 e3cf1C19 e3cf1C21	P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like	LigPlot
1E32	Download	Experimental	e1e32A5 e1e32A7	P-loop domains-like Histone-like	LigPlot
3CF0	Download	Experimental	e3cf0A3 e3cf0A4 e3cf0N3 e3cf0N4 e3cf0B3 e3cf0B4 e3cf0C3 e3cf0C4 e3cf0D3 e3cf0D4 e3cf0E3 e3cf0E4 e3cf0F3 e3cf0F4 e3cf0G3 e3cf0G4 e3cf0H3 e3cf0H4 e3cf0F3 e3cf0I3 e3cf0I4 e3cf0J3 e3cf0J4 e3cf0K3 e3cf0K4 e3cf0L3 e3cf0L4 e3cf0M3 e3cf0M4 e3cf0N3 e3cf0N4	P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like Histone-like	LigPlot
1R7R	Download	Experimental	e1r7rA5 e1r7rA7	P-loop domains-like Histone-like	LigPlot
3CF2	Download	Experimental	e3cf2A3 e3cf2A7 e3cf2B3 e3cf2B3 e3cf2B7 e3cf2C3 e3cf2C7 e3cf2D3 e3cf2D3 e3cf2D7	P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like P-loop domains-like Histone-like P-loop domains-like P-loop domains-like Histone-like	LigPlot