ADENOSINE A2B RECEPTOR INTERACTION INVESTIGATION IN SILICO

Kód výsledku v IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F70883521%3A28140%2F10%3A63509207" target="_blank" >RIV/70883521:28140/10:63509207 - isvavai.cz</a>

Výsledek na webu

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DOI - Digital Object Identifier

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Jazyk výsledku

angličtina

Název v původním jazyce

ADENOSINE A2B RECEPTOR INTERACTION INVESTIGATION IN SILICO

Popis výsledku v původním jazyce

This research was devoted to study of adenosine receptors A2B subtype, which is not full studied. The research?s aim was to create computer models of A2B adenosine receptor, and also its 9 activators and 15inhibitors; using these models to analyze special features of interaction between A2B adenosine receptor molecule and molecules of different activators and inhibitors in silico. The amino acid sequence of A2B receptors was taken from open source in the NCBI data base, ID: NP_000667.1, for modeling ?2Badenosine receptor and its mutant forms the MODELLER software was used. The modeling of ligand- receptor interaction was made on the supercomputer SKIF Cyberia (Tomsk State University, Russia) using AutoDock 4.0 as the part of MGL Tools 1.4.5. In this research work, realized on the unique A2B adenosine receptor computer model, it was shown, that both activators and inhibitors produce the hydrogen bindings with different amino acids as a result of interaction between them and A2B adenosi

Název v anglickém jazyce

ADENOSINE A2B RECEPTOR INTERACTION INVESTIGATION IN SILICO

Popis výsledku anglicky

This research was devoted to study of adenosine receptors A2B subtype, which is not full studied. The research?s aim was to create computer models of A2B adenosine receptor, and also its 9 activators and 15inhibitors; using these models to analyze special features of interaction between A2B adenosine receptor molecule and molecules of different activators and inhibitors in silico. The amino acid sequence of A2B receptors was taken from open source in the NCBI data base, ID: NP_000667.1, for modeling ?2Badenosine receptor and its mutant forms the MODELLER software was used. The modeling of ligand- receptor interaction was made on the supercomputer SKIF Cyberia (Tomsk State University, Russia) using AutoDock 4.0 as the part of MGL Tools 1.4.5. In this research work, realized on the unique A2B adenosine receptor computer model, it was shown, that both activators and inhibitors produce the hydrogen bindings with different amino acids as a result of interaction between them and A2B adenosi

Druh

J_x - Nezařazeno - Článek v odborném periodiku (Jimp, Jsc a Jost)

CEP obor

JD - Využití počítačů, robotika a její aplikace

OECD FORD obor

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Projekt

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Návaznosti

S - Specificky vyzkum na vysokych skolach

Rok uplatnění

2010

Kód důvěrnosti údajů

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Název periodika

Physiological research

ISSN

1802-9973

e-ISSN

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Svazek periodika

59

Číslo periodika v rámci svazku

5

Stát vydavatele periodika

CZ - Česká republika

Počet stran výsledku

38

Strana od-do

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Kód UT WoS článku

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EID výsledku v databázi Scopus

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