Nucleosides, nucleotides and nucleic acids p. 613 - 624 (2004)
Update date:2022-08-03
Topics:
Moosavi-Movahedi
Safarian
Hakimelahi
Ataei
Ajloo
Panjehpour
Riahi
Mousavi
Mardanyan
Soltani
Khalafi-Nezhad
Sharghi
Moghadamnia
Saboury
The kinetic parameters of adenosine deaminase such as Km and Ki were determined in the absence and presence of adenine derivatives (R1- R24) in sodium phosphate buffer (50 mM; pH 7.5) solution at 27°C. These kinetic parameters were used for QSAR analysis. As such, we found some theoretical descriptors to which the binding affinity of adenosine deaminase (ADA) towards several adenine nucleosides as inhibitors is correlated. QSAR analysis has revealed that binding affinity of the adenine nucleosides upon interaction with ADA depends on the molecular volume, dipole moment of the molecule, electric charge around the N1 atom, and the highest of positive charge for the related molecules.
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