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 Q877G8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5W74	Download	Experimental	e5w74A2 e5w74A3 e5w74B2 e5w74B3 e5w74C1 e5w74C3 e5w74D2 e5w74D3 e5w74E1 e5w74E2 e5w74F1 e5w74F3 e5w74G1 e5w74G3 e5w74H2 e5w74H3	GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like Zincin-like GroEL equatorial domain-like	LigPlot
3KFE	Download	Experimental	e3kfeA5 e3kfeA6 e3kfeB5 e3kfeB6 e3kfeC5 e3kfeC6 e3kfeD5 e3kfeD6 e3kfeE5 e3kfeE6 e3kfeF5 e3kfeF6 e3kfeG5 e3kfeG6 e3kfeH5 e3kfeH6	GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like GroEL equatorial domain-like Zincin-like 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
3RUS	Download	Experimental	e3rusA1 e3rusA2 e3rusB1 e3rusB2 e3rusC1 e3rusC2 e3rusD1 e3rusD2	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
3RUQ	Download	Experimental	e3ruqA1 e3ruqA2 e3ruqB1 e3ruqB2 e3ruqC1 e3ruqC2 e3ruqD1 e3ruqD2	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
3RUW	Download	Experimental	e3ruwA1 e3ruwA2 e3ruwB1 e3ruwB2 e3ruwC1 e3ruwC2 e3ruwD1 e3ruwD2	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