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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

Version of Record online: 13 APR 2012 | DOI: 10.1002/qua.24131

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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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