Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology

Abstract Mycobacteroides abscessus (Previously Mycobacterium abscessus) is an emerging microorganism of the newly defined genera Mycobacteroides that causes mainly skin and tissue diseases in humans. The recent availability of total 34 fully sequenced genomes of different strains belonging to this s...

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Autores principales: Hamza Arshad Dar, Saba Ismail, Yasir Waheed, Sajjad Ahmad, Zubia Jamil, Hafsa Aziz, Helal F. Hetta, Khalid Muhammad
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Publicado: Nature Portfolio 2021
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Acceso en línea:https://doaj.org/article/173e4f38ae614439a7fe47c9cb2fba38
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spelling oai:doaj.org-article:173e4f38ae614439a7fe47c9cb2fba382021-12-02T14:49:17ZDesigning a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology10.1038/s41598-021-90868-22045-2322https://doaj.org/article/173e4f38ae614439a7fe47c9cb2fba382021-05-01T00:00:00Zhttps://doi.org/10.1038/s41598-021-90868-2https://doaj.org/toc/2045-2322Abstract Mycobacteroides abscessus (Previously Mycobacterium abscessus) is an emerging microorganism of the newly defined genera Mycobacteroides that causes mainly skin and tissue diseases in humans. The recent availability of total 34 fully sequenced genomes of different strains belonging to this species has provided an opportunity to utilize this genomics data to gain novel insights and guide the development of specific antimicrobial therapies. In the present study, we collected collectively 34 complete genome sequences of M. abscessus from the NCBI GenBank database. Pangenome analysis was conducted on these genomes to understand the genetic diversity and to obtain proteins associated with its core genome. These core proteins were then subjected to various subtractive filters to identify potential antigenic targets that were subjected to multi-epitope vaccine design. Our analysis projected the open pangenome of M. abscessus containing 3443 core genes. After applying various stepwise filtration steps on the core proteins, a total of four potential antigenic targets were identified. Utilizing their constituent CD4 and CD8 T-cell epitopes, a multi-epitope based subunit vaccine was computationally designed. Sequence-based analysis as well as structural characterization revealed the immunological effectiveness of this designed vaccine. Further molecular docking, molecular dynamics simulation and binding free energy estimation with Toll-like receptor 2 indicated strong structural associations of the vaccine with the immune receptor. The promising results are encouraging and need to be validated by additional wet laboratory studies for confirmation.Hamza Arshad DarSaba IsmailYasir WaheedSajjad AhmadZubia JamilHafsa AzizHelal F. HettaKhalid MuhammadNature PortfolioarticleMedicineRScienceQENScientific Reports, Vol 11, Iss 1, Pp 1-18 (2021)
institution DOAJ
collection DOAJ
language EN
topic Medicine
R
Science
Q
spellingShingle Medicine
R
Science
Q
Hamza Arshad Dar
Saba Ismail
Yasir Waheed
Sajjad Ahmad
Zubia Jamil
Hafsa Aziz
Helal F. Hetta
Khalid Muhammad
Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
description Abstract Mycobacteroides abscessus (Previously Mycobacterium abscessus) is an emerging microorganism of the newly defined genera Mycobacteroides that causes mainly skin and tissue diseases in humans. The recent availability of total 34 fully sequenced genomes of different strains belonging to this species has provided an opportunity to utilize this genomics data to gain novel insights and guide the development of specific antimicrobial therapies. In the present study, we collected collectively 34 complete genome sequences of M. abscessus from the NCBI GenBank database. Pangenome analysis was conducted on these genomes to understand the genetic diversity and to obtain proteins associated with its core genome. These core proteins were then subjected to various subtractive filters to identify potential antigenic targets that were subjected to multi-epitope vaccine design. Our analysis projected the open pangenome of M. abscessus containing 3443 core genes. After applying various stepwise filtration steps on the core proteins, a total of four potential antigenic targets were identified. Utilizing their constituent CD4 and CD8 T-cell epitopes, a multi-epitope based subunit vaccine was computationally designed. Sequence-based analysis as well as structural characterization revealed the immunological effectiveness of this designed vaccine. Further molecular docking, molecular dynamics simulation and binding free energy estimation with Toll-like receptor 2 indicated strong structural associations of the vaccine with the immune receptor. The promising results are encouraging and need to be validated by additional wet laboratory studies for confirmation.
format article
author Hamza Arshad Dar
Saba Ismail
Yasir Waheed
Sajjad Ahmad
Zubia Jamil
Hafsa Aziz
Helal F. Hetta
Khalid Muhammad
author_facet Hamza Arshad Dar
Saba Ismail
Yasir Waheed
Sajjad Ahmad
Zubia Jamil
Hafsa Aziz
Helal F. Hetta
Khalid Muhammad
author_sort Hamza Arshad Dar
title Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
title_short Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
title_full Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
title_fullStr Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
title_full_unstemmed Designing a multi-epitope vaccine against Mycobacteroides abscessus by pangenome-reverse vaccinology
title_sort designing a multi-epitope vaccine against mycobacteroides abscessus by pangenome-reverse vaccinology
publisher Nature Portfolio
publishDate 2021
url https://doaj.org/article/173e4f38ae614439a7fe47c9cb2fba38
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