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Exploring <i>Solanum tuberosum</i> Epoxide Hydrolase Internal Architecture by Water Molecules Tracking

Several different approaches are used to describe the role of protein compartments and residues in catalysis and to identify key residues suitable for the modification of the activity or selectivity of the desired enzyme. In our research, we applied a combination of molecular dynamics simulations an...

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Principais autores: Karolina Mitusińska, Tomasz Magdziarz, Maria Bzówka, Agnieszka Stańczak, Artur Góra
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI AG 2018-11-01
coleção:Biomolecules
Assuntos:
epoxide hydrolases
cavities
tunnels
water trajectories
protein engineering
MD simulations
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Acesso em linha:https://www.mdpi.com/2218-273X/8/4/143
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