Jinhu Wang, Qianqian Hou, Xiang Sheng, Jun Gao, Yongjun Liu and Chengbu Liu Theoretical study on the deglycosylation mechanism of rice BGlu1 β-glucosidase International Journal of Quantum Chemistry 113
β-Glycosidases are able to catalytically hydrolyze the very stable glycosidic bond. Rice BGlu1 enzyme, among the β-glucosidases, more efficiently hydrolyzes cello-oligosaccharides. Using the quantum mechanical/molecular mechanical approach, the deglycosylation step of the rice BGlu1 enzyme is studied, identifying the structure of the transition state, as well as the function of key residues.
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