Multi-epitopes Vaccine Design against Klebsiella pneumoniae based on Outer Membrane Protein using Immunoinformatics Approaches

Q3 Pharmacology, Toxicology and Pharmaceutics
Indira Prakoso, Alfero Putra Iryanto, Tiara Rahayu, Anzillina Rahma, Muhammad Nur Aziz Ar Rizqi, V. D. Kharisma, Arif Nur Muhammad Ansori, M. Rebezov, P. Burkov, Marina Derkho, Belyakova Natalia, Rybakova Anna, V. Jakhmola, R. Zainul
{"title":"Multi-epitopes Vaccine Design against Klebsiella pneumoniae based on Outer Membrane Protein using Immunoinformatics Approaches","authors":"Indira Prakoso, Alfero Putra Iryanto, Tiara Rahayu, Anzillina Rahma, Muhammad Nur Aziz Ar Rizqi, V. D. Kharisma, Arif Nur Muhammad Ansori, M. Rebezov, P. Burkov, Marina Derkho, Belyakova Natalia, Rybakova Anna, V. Jakhmola, R. Zainul","doi":"10.52711/0974-360x.2024.00003","DOIUrl":null,"url":null,"abstract":"Klebsiella pneumoniae is a gram-negative of bacteria that are known to cause a variety of nosocomial respiratory tract infections including pneumonia. K. pneumoniae is also included in the ESKAPE bacteria group which has high resistance to antibiotics. Therefore, alternative treatment for K. pneumoniae infection is needed, one of which is by developing a vaccine. The aim of this study was to design a vaccine against K. pneumoniae by targeting the outer membrane protein using immunoinformatics approaches. 1,708 protein of K. pneumoniae was then screened using signalP, pred-TMBB2, and Blastp to select outer membrane proteins. The selected protein, PA1_KLEPN and BAMA_KLEP7 were then predicted using T-and B-cell Epitope Prediction on IEDB to obtain epitope regions. Vaccine design of K. pneumoniae consists of 1 BCL epitope, 2 CTL epitopes, 1 HTL epitope, an adjuvant and PADRE sequences constructed with linkers using Benchling. This vaccine construction is predicted to be non-toxic/allergenic and have a strong binding affinity with human TLR-4 with the HADDOCK score of -93.2kcal/mol, RMSD 0.5 and Z-score -2.5. According to the computer-aided studies conducted for this study, the chosen epitopes may provide excellent vaccine candidates to stop K. pneumoniae infections in people. However, in order to further confirm the efficacy of this suggested vaccine candidate, in vitro and in vivo validation is required.","PeriodicalId":21141,"journal":{"name":"Research Journal of Pharmacy and Technology","volume":"6 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2024-01-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Research Journal of Pharmacy and Technology","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.52711/0974-360x.2024.00003","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"Pharmacology, Toxicology and Pharmaceutics","Score":null,"Total":0}
引用次数: 0

Abstract

Klebsiella pneumoniae is a gram-negative of bacteria that are known to cause a variety of nosocomial respiratory tract infections including pneumonia. K. pneumoniae is also included in the ESKAPE bacteria group which has high resistance to antibiotics. Therefore, alternative treatment for K. pneumoniae infection is needed, one of which is by developing a vaccine. The aim of this study was to design a vaccine against K. pneumoniae by targeting the outer membrane protein using immunoinformatics approaches. 1,708 protein of K. pneumoniae was then screened using signalP, pred-TMBB2, and Blastp to select outer membrane proteins. The selected protein, PA1_KLEPN and BAMA_KLEP7 were then predicted using T-and B-cell Epitope Prediction on IEDB to obtain epitope regions. Vaccine design of K. pneumoniae consists of 1 BCL epitope, 2 CTL epitopes, 1 HTL epitope, an adjuvant and PADRE sequences constructed with linkers using Benchling. This vaccine construction is predicted to be non-toxic/allergenic and have a strong binding affinity with human TLR-4 with the HADDOCK score of -93.2kcal/mol, RMSD 0.5 and Z-score -2.5. According to the computer-aided studies conducted for this study, the chosen epitopes may provide excellent vaccine candidates to stop K. pneumoniae infections in people. However, in order to further confirm the efficacy of this suggested vaccine candidate, in vitro and in vivo validation is required.
利用免疫信息学方法设计基于外膜蛋白的肺炎克雷伯菌多位点疫苗
肺炎克雷伯菌是一种革兰氏阴性细菌,已知可引起包括肺炎在内的各种院内呼吸道感染。肺炎克雷伯菌也属于 ESKAPE 菌群,对抗生素有很强的耐药性。因此,肺炎克氏菌感染需要替代治疗方法,其中之一就是开发疫苗。本研究的目的是利用免疫信息学方法,针对肺炎克氏菌的外膜蛋白设计一种疫苗。研究人员使用 signalP、pred-TMBB2 和 Blastp 筛选了 1 708 个肺炎双球菌蛋白,以筛选出外膜蛋白。然后利用 IEDB 上的 T 细胞和 B 细胞表位预测法预测了 PA1_KLEPN 和 BAMA_KLEP7 蛋白的表位区。肺炎克氏菌疫苗设计由 1 个 BCL 表位、2 个 CTL 表位、1 个 HTL 表位、佐剂和 PADRE 序列组成,并使用 Benchling 构建了连接体。据预测,该疫苗结构无毒/致敏,与人类 TLR-4 有很强的结合亲和力,HADDOCK 得分为 -93.2kcal/mol,RMSD 为 0.5,Z-score 为 -2.5。根据为本研究进行的计算机辅助研究,所选表位可能是阻止肺炎克雷伯菌感染人类的极佳候选疫苗。然而,为了进一步证实这种候选疫苗的有效性,还需要进行体外和体内验证。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
求助全文
约1分钟内获得全文 求助全文
来源期刊
Research Journal of Pharmacy and Technology
Research Journal of Pharmacy and Technology Pharmacology, Toxicology and Pharmaceutics-Pharmacology, Toxicology and Pharmaceutics (miscellaneous)
CiteScore
1.40
自引率
0.00%
发文量
0
期刊介绍: Research Journal of Pharmacy and Technology (RJPT) is an international, peer-reviewed, multidisciplinary journal, devoted to pharmaceutical sciences. The aim of RJPT is to increase the impact of pharmaceutical research both in academia and industry, with strong emphasis on quality and originality. RJPT publishes Original Research Articles, Short Communications, Review Articles in all areas of pharmaceutical sciences from the discovery of a drug up to clinical evaluation. Topics covered are: Pharmaceutics and Pharmacokinetics; Pharmaceutical chemistry including medicinal and analytical chemistry; Pharmacognosy including herbal products standardization and Phytochemistry; Pharmacology: Allied sciences including drug regulatory affairs, Pharmaceutical Marketing, Pharmaceutical Microbiology, Pharmaceutical biochemistry, Pharmaceutical Education and Hospital Pharmacy.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信