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A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization

The recent release of COVID-19 spike glycoprotein allows detailed analysis of the structural features that are required for stabilizing the infective form of its quaternary assembly. Trying to disassemble the trimeric structure of COVID-19 spike glycoprotein, we analyzed single protomer surfaces sea...

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Detalles Bibliográficos
Autores principales: Bongini, Pietro, Trezza, Alfonso, Bianchini, Monica, Spiga, Ottavia, Niccolai, Neri
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Published by Elsevier Inc. 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7144664/
https://www.ncbi.nlm.nih.gov/pubmed/32451080
http://dx.doi.org/10.1016/j.bbrc.2020.04.007
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author Bongini, Pietro
Trezza, Alfonso
Bianchini, Monica
Spiga, Ottavia
Niccolai, Neri
author_facet Bongini, Pietro
Trezza, Alfonso
Bianchini, Monica
Spiga, Ottavia
Niccolai, Neri
author_sort Bongini, Pietro
collection PubMed
description The recent release of COVID-19 spike glycoprotein allows detailed analysis of the structural features that are required for stabilizing the infective form of its quaternary assembly. Trying to disassemble the trimeric structure of COVID-19 spike glycoprotein, we analyzed single protomer surfaces searching for concave moieties that are located at the three protomer-protomer interfaces. The presence of some druggable pockets at these interfaces suggested that some of the available drugs in Drug Bank could destabilize the quaternary spike glycoprotein formation by binding to these pockets, therefore interfering with COVID-19 life cycle. The approach we propose here can be an additional strategy to fight against the deadly virus. Ligands of COVID-19 spike glycoprotein that we have predicted in the present computational investigation, might be the basis for new experimental studies in vitro and in vivo.
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spelling pubmed-71446642020-04-09 A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization Bongini, Pietro Trezza, Alfonso Bianchini, Monica Spiga, Ottavia Niccolai, Neri Biochem Biophys Res Commun Article The recent release of COVID-19 spike glycoprotein allows detailed analysis of the structural features that are required for stabilizing the infective form of its quaternary assembly. Trying to disassemble the trimeric structure of COVID-19 spike glycoprotein, we analyzed single protomer surfaces searching for concave moieties that are located at the three protomer-protomer interfaces. The presence of some druggable pockets at these interfaces suggested that some of the available drugs in Drug Bank could destabilize the quaternary spike glycoprotein formation by binding to these pockets, therefore interfering with COVID-19 life cycle. The approach we propose here can be an additional strategy to fight against the deadly virus. Ligands of COVID-19 spike glycoprotein that we have predicted in the present computational investigation, might be the basis for new experimental studies in vitro and in vivo. Published by Elsevier Inc. 2020-07-12 2020-04-09 /pmc/articles/PMC7144664/ /pubmed/32451080 http://dx.doi.org/10.1016/j.bbrc.2020.04.007 Text en © 2020 Published by Elsevier Inc. Since January 2020 Elsevier has created a COVID-19 resource centre with free information in English and Mandarin on the novel coronavirus COVID-19. The COVID-19 resource centre is hosted on Elsevier Connect, the company's public news and information website. Elsevier hereby grants permission to make all its COVID-19-related research that is available on the COVID-19 resource centre - including this research content - immediately available in PubMed Central and other publicly funded repositories, such as the WHO COVID database with rights for unrestricted research re-use and analyses in any form or by any means with acknowledgement of the original source. These permissions are granted for free by Elsevier for as long as the COVID-19 resource centre remains active.
spellingShingle Article
Bongini, Pietro
Trezza, Alfonso
Bianchini, Monica
Spiga, Ottavia
Niccolai, Neri
A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title_full A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title_fullStr A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title_full_unstemmed A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title_short A possible strategy to fight COVID-19: Interfering with spike glycoprotein trimerization
title_sort possible strategy to fight covid-19: interfering with spike glycoprotein trimerization
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7144664/
https://www.ncbi.nlm.nih.gov/pubmed/32451080
http://dx.doi.org/10.1016/j.bbrc.2020.04.007
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