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@article{840980,
author = {Damborský, Jiří and Brezovský, Jan},
article_location = {England},
article_number = {13},
keywords = {protein; engineering; biocatalysts},
language = {eng},
issn = {1367-5931},
journal = {CURRENT OPINION IN BIOLOGICAL CHEMISTRY},
title = {Computational Tools for Designing and Engineering Biocatalysts.},
url = {http://loschmidt.chemi.muni.cz/peg/pdf/cochbi09.pdf},
volume = {1},
year = {2009}
}
TY - JOUR
ID - 840980
AU - Damborský, Jiří - Brezovský, Jan
PY - 2009
TI - Computational Tools for Designing and Engineering Biocatalysts.
JF - CURRENT OPINION IN BIOLOGICAL CHEMISTRY
VL - 1
IS - 13
SP - 26-34
EP - 26-34
SN - 13675931
KW - protein
KW - engineering
KW - biocatalysts
UR - http://loschmidt.chemi.muni.cz/peg/pdf/cochbi09.pdf
N2 - Current computational tools to assist experimentalists for the design and engineering of proteins with desired catalytic properties are reviewed. The applications of these tools for de novo design of protein active sites, optimization of substrate access and product exit pathways, redesign of protein protein interfaces, identification of neutral/advantageous/deleterious mutations in the libraries from directed evolution and stabilization of protein structures are described. Remarkable progress is seen in de novo design of enzymes catalyzing a chemical reaction for which a natural biocatalyst does not exist. Yet, constructed biocatalysts do not match natural enzymes in their efficiency, suggesting that more research is needed to capture all the important features of natural biocatalysts in theoretical designs.
ER -
DAMBORSKÝ, Jiří a Jan BREZOVSKÝ. Computational Tools for Designing and Engineering Biocatalysts. \textit{CURRENT OPINION IN BIOLOGICAL CHEMISTRY}. England, 2009, roč.~1, č.~13, s.~26-34. ISSN~1367-5931.
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