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Immunoinformatics and molecular dynamics approaches: Next generation vaccine design against West Nile virus.

Authors :
Khan MT
Islam R
Jerin TJ
Mahmud A
Khatun S
Kobir A
Islam MN
Akter A
Mondal SI
Source :
PloS one [PLoS One] 2021 Jun 17; Vol. 16 (6), pp. e0253393. Date of Electronic Publication: 2021 Jun 17 (Print Publication: 2021).
Publication Year :
2021

Abstract

West Nile Virus (WNV) is a life threatening flavivirus that causes significant morbidity and mortality worldwide. No preventive therapeutics including vaccines against WNV are available for human use. In this study, immunoinformatics approach was performed to design a multi epitope-based subunit vaccine against this deadly pathogen. Human (HLA) and Mice (H-2) allele specific potential T-cell and B-cell epitopes were shortlisted through a stringent procedure. Molecular docking showed selected epitopes that have stronger binding affinity with human TLR-4. Molecular dynamics simulation confirmed the stable nature of the docked complex. Furthermore, in silico cloning analysis ensures efficient expression of desired gene in the microbial system. Interestingly, previous studies showed that two of our selected epitopes have strong immune response against WNV. Therefore, selected epitopes could be strong vaccine candidates to prevent WNV infections in human. However, further in vitro and in vivo investigations could be strengthening the validation of the vaccine candidate against WNV.<br />Competing Interests: The authors have declared that no competing interests exist.

Details

Language :
English
ISSN :
1932-6203
Volume :
16
Issue :
6
Database :
MEDLINE
Journal :
PloS one
Publication Type :
Academic Journal
Accession number :
34138958
Full Text :
https://doi.org/10.1371/journal.pone.0253393