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Computational tools for designing and engineering enzymes
J. Damborsky, J. Brezovsky,
Jazyk angličtina Země Anglie, Velká Británie
Typ dokumentu časopisecké články, práce podpořená grantem, přehledy
Odkazy
PubMed
24780274
DOI
10.1016/j.cbpa.2013.12.003
Knihovny.cz E-zdroje
- MeSH
- enzymy genetika MeSH
- lidé MeSH
- molekulární modely MeSH
- mutace MeSH
- proteinové inženýrství metody MeSH
- stabilita enzymů MeSH
- výpočetní biologie metody MeSH
- Check Tag
- lidé MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- přehledy MeSH
Protein engineering strategies aimed at constructing enzymes with novel or improved activities, specificities, and stabilities greatly benefit from in silico methods. Computational methods can be principally grouped into three main categories: bioinformatics; molecular modelling; and de novo design. Particularly de novo protein design is experiencing rapid development, resulting in more robust and reliable predictions. A recent trend in the field is to combine several computational approaches in an interactive manner and to complement them with structural analysis and directed evolution. A detailed investigation of designed catalysts provides valuable information on the structural basis of molecular recognition, biochemical catalysis, and natural protein evolution.
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