Rational design of multi epitope-based subunit vaccine by exploring MERS-COV proteome: Reverse vaccinology and molecular docking approach

被引:29
作者
Ashfaq, Usman Ali [1 ]
Saleem, Saman [1 ]
Masoud, Muhammad Shareef [1 ]
Ahmad, Matloob [2 ]
Nahid, Nazia [1 ]
Bhatti, Rashid [3 ]
Almatroudi, Ahmad [4 ]
Khurshid, Mohsin [5 ]
机构
[1] Govt Coll Univ, Dept Bioinformat & Biotechnol, Faisalabad, Pakistan
[2] Govt Coll Univ, Dept Chem, Faisalabad, Pakistan
[3] Univ Punjab, Ctr Excellence Mol Biol, Lahore, Pakistan
[4] Qassim Univ, Coll Appl Med Sci, Dept Med Labs, Buraydah, Saudi Arabia
[5] Govt Coll Univ, Dept Microbiol, Faisalabad, Pakistan
关键词
PREDICTION; INFECTION; CONSENSUS; PROTEINS; ALLELES;
D O I
10.1371/journal.pone.0245072
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
070301 [无机化学]; 070403 [天体物理学]; 070507 [自然资源与国土空间规划学]; 090105 [作物生产系统与生态工程];
摘要
Middle East respiratory syndrome (MERS-COV), first identified in Saudi Arabia, was caused by a novel strain of coronavirus. Outbreaks were recorded from different regions of the world, especially South Korea and the Middle East, and were correlated with a 35% mortality rate. MERS-COV is a single-stranded, positive RNA virus that reaches the host by binding to the receptor of dipeptidyl-peptides. Because of the unavailability of the vaccine available for the protection from MERS-COV infection, the rapid case detection, isolation, infection prevention has been recommended to combat MERS-COV infection. So, vaccines for the treatment of MERS-COV infection need to be developed urgently. A possible antiviral mechanism for preventing MERS-CoV infection has been considered to be MERS-CoV vaccines that elicit unique T-cell responses. In the present study, we incorporated both molecular docking and immunoinformatic approach to introduce a multiepitope vaccine (MEP) against MERS-CoV by selecting 15 conserved epitopes from seven viral proteins such as three structural proteins (envelope, membrane, and nucleoprotein) and four non-structural proteins (ORF1a, ORF8, ORF3, ORF4a). The epitopes, which were examined for non-homologous to host and antigenicity, were selected on the basis of conservation between T-cell, B-cell, and IFN-gamma epitopes. The selected epitopes were then connected to the adjuvant (beta-defensin) at the N-terminal through an AAY linker to increase the immunogenic potential. Structural modelling and physiochemical characteristic were applied to the vaccine construct developed. Afterwards the structure has been successfully docked with antigenic receptor, Toll-like receptor 3 (TLR-3) and in-silico cloning ensures that its expression efficiency is legitimate. Nonetheless the MEP presented needs tests to verify its safety and immunogenic profile.
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页数:18
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共 70 条
[1]
Abu-Haraz A.H., 2017, ADV TECH BIOL MED, V5, P1764, DOI [10.4172/2379-1764.1000203, DOI 10.4172/2379-1764.1000203]
[2]
Conserved B and T cell epitopes prediction of ebola virus glycoprotein for vaccine development: An immuno-informatics approach [J].
Ahmad, Bilal ;
Ashfaq, Usman Ali ;
Rahman, Mahmood-ur ;
Masoud, Muhammad Shareef ;
Yousaf, Muhammad Zubair .
MICROBIAL PATHOGENESIS, 2019, 132 :243-253
[3]
Immunoinformatic and systems biology approaches to predict and validate peptide vaccines against Epstein-Barr virus (EBV) [J].
Ali, Arif ;
Khan, Abbas ;
Kaushik, Aman Chandra ;
Wang, Yanjie ;
Ali, Syed Shujait ;
Junaid, Muhammad ;
Saleem, Shoaib ;
Cho, William C. S. ;
Mao, Xueying ;
Wei, Dong-Qing .
SCIENTIFIC REPORTS, 2019, 9 (1)
[4]
Contributions of humoral and cellular immunity to vaccine-induced protection in humans [J].
Amanna, Ian J. ;
Slifka, Mark K. .
VIROLOGY, 2011, 411 (02) :206-215
[5]
[Anonymous], 2018, KLS OCT, DOI DOI 10.18502/KLS.V4I6.3094
[6]
Design of the linkers which effectively separate domains of a bifunctional fusion protein [J].
Arai, R ;
Ueda, H ;
Kitayama, A ;
Kamiya, N ;
Nagamune, T .
PROTEIN ENGINEERING, 2001, 14 (08) :529-532
[7]
De Novo Structural Modeling and Conserved Epitopes Prediction of Zika Virus Envelop Protein for Vaccine Development [J].
Ashfaq, Usman Ali ;
Ahmed, Bilal .
VIRAL IMMUNOLOGY, 2016, 29 (07) :436-443
[8]
THE FOCUSING POSITIONS OF POLYPEPTIDES IN IMMOBILIZED PH GRADIENTS CAN BE PREDICTED FROM THEIR AMINO-ACID-SEQUENCES [J].
BJELLQVIST, B ;
HUGHES, GJ ;
PASQUALI, C ;
PAQUET, N ;
RAVIER, F ;
SANCHEZ, JC ;
FRUTIGER, S ;
HOCHSTRASSER, D .
ELECTROPHORESIS, 1993, 14 (10) :1023-1031
[9]
Acute hepatitis C virus infection: A chronic problem [J].
Blackard, Jason T. ;
Shata, M. Tarek ;
Shire, Norah J. ;
Sherman, Kenneth E. .
HEPATOLOGY, 2008, 47 (01) :321-331
[10]
Bolis S, 2018, IMMUNOINFORMATICS PR