Theoretical study of the lectin-carbohydrate interactions
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216224%3A14310%2F08%3A00028052" target="_blank" >RIV/00216224:14310/08:00028052 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
Theoretical study of the lectin-carbohydrate interactions
Original language description
We used Molecular Mechanics Poisson Boltzmann model in combination of normal mode analysis to elucidate the free energy of the binding and conversely its consequences on the complex conformations. Solvent analysis in the apo form lectin exhibited that the water cluster exactly fits to the key hydroxyl groups of the carbohydrate in the holo form.
Czech name
Teoretické studie interakcí mezi lektiny a sacharidy
Czech description
Výpočty energií interakcí lektinu se sacharidy s využitím MMPBSA.
Classification
Type
D - Article in proceedings
CEP classification
CE - Biochemistry
OECD FORD branch
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Result continuities
Project
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Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)
Others
Publication year
2008
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Article name in the collection
FEBS Journal Volume 275 Supplement 1
ISBN
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ISSN
1742-464X
e-ISSN
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Number of pages
1
Pages from-to
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Publisher name
Blackwell Publishing Ltd.
Place of publication
Oxford (UK)
Event location
Athens, Greece
Event date
Jun 28, 2008
Type of event by nationality
WRD - Celosvětová akce
UT code for WoS article
000256633301636