Secreted Aspartyl Proteinases Targeted Multi-Epitope Vaccine Design for Candida dubliniensis Using Immunoinformatics.
Nahid AkhtarJorge Samuel Leon MagdalenoSuryakant RanjanAtif Khurshid WaniRavneet Kaur GrewalRomina OlivaAbdul Rajjak ShaikhLuigi CavalloMohit ChawlaPublished in: Vaccines (2023)
Candida dubliniensis is an opportunistic pathogen associated with oral and invasive fungal infections in immune-compromised individuals. Furthermore, the emergence of C. dubliniensis antifungal drug resistance could exacerbate its treatment. Hence, in this study a multi-epitope vaccine candidate has been designed using an immunoinformatics approach by targeting C. dubliniensis secreted aspartyl proteinases (SAP) proteins. In silico tools have been utilized to predict epitopes and determine their allergic potential, antigenic potential, toxicity, and potential to elicit interleukin-2 (IL2), interleukin-4 (IL4), and IFN-γ. Using the computational tools, eight epitopes have been predicted that were then linked with adjuvants for final vaccine candidate development. Computational immune simulation has depicted that the immunogen designed emerges as a strong immunogenic candidate for a vaccine. Further, molecular docking and molecular dynamics simulation analyses revealed stable interactions between the vaccine candidate and the human toll-like receptor 5 (TLR5). Finally, immune simulations corroborated the promising candidature of the designed vaccine, thus calling for further in vivo investigation.
Keyphrases
- molecular docking
- toll like receptor
- molecular dynamics simulations
- candida albicans
- immune response
- inflammatory response
- nuclear factor
- endothelial cells
- oxidative stress
- human health
- biofilm formation
- escherichia coli
- dendritic cells
- pseudomonas aeruginosa
- staphylococcus aureus
- cystic fibrosis
- combination therapy