PMID- 38541659 OWN - NLM STAT- PubMed-not-MEDLINE LR - 20240330 IS - 2075-1729 (Print) IS - 2075-1729 (Electronic) IS - 2075-1729 (Linking) VI - 14 IP - 3 DP - 2024 Mar 2 TI - An Exploratory Bioinformatic Investigation of Cats' Susceptibility to Coronavirus-Deriving Epitopes. LID - 10.3390/life14030334 [doi] LID - 334 AB - Coronaviruses are highly transmissible and pathogenic viruses for humans and animals. The vast quantity of information collected about SARS-CoV-2 during the pandemic helped to unveil details of the mechanisms behind the infection, which are still largely elusive. Recent research demonstrated that different class I/II human leukocyte antigen (HLA) alleles might define an individual susceptibility to SARS-CoV-2 spreading, contributing to the differences in the distribution of the infection through different populations; additional studies suggested that the homolog of the HLA in cats, the feline leukocyte antigen (FLA), plays a pivotal role in the transmission of viruses. With these premises, this study aimed to exploit a bioinformatic approach for the prediction of the transmissibility potential of two distinct feline coronaviruses (FCoVs) in domestic cats (feline enteric coronavirus (FeCV) and feline infectious peritonitis virus (FIPV)) using SARS-CoV-2 as the reference model. We performed an epitope mapping of nonapeptides deriving from SARS-CoV-2, FeCV, and FIPV glycoproteins and predicted their affinities for different alleles included in the three main loci in class I FLAs (E, H, and K). The predicted complexes with the most promising affinities were then subjected to molecular docking and molecular dynamics simulations to provide insights into the stability and binding energies in the cleft. Results showed the FLA proteins encoded by alleles in the FLA-I H (H*00501 and H*00401) and E (E*01001 and E*00701) loci are largely responsive to several epitopes deriving from replicase and spike proteins of the analyzed coronaviruses. The analysis of the most affine epitope sequences resulting from the prediction can stimulate the development of anti-FCoV immunomodulatory strategies based on peptide drugs. FAU - Buonocore, Michela AU - Buonocore M AD - Department of Veterinary Medicine and Animal Production, University of Naples Federico II, Via Federico Delpino, 1, 80137 Napoli, Italy. AD - Department of Chemical Sciences, Research Centre on Bioactive Peptides (CIRPeB), University of Naples Federico II, Complesso Universitario di Monte Sant'Angelo, Via Cintia, 80126 Naples, Italy. FAU - De Biase, Davide AU - De Biase D AUID- ORCID: 0000-0002-8118-9807 AD - Department of Pharmacy, University of Salerno, Via Giovanni Paolo II, 132, 84084 Fisciano, Italy. FAU - Sorrentino, Domenico AU - Sorrentino D AD - Department of Pharmacy, University of Salerno, Via Giovanni Paolo II, 132, 84084 Fisciano, Italy. FAU - Giordano, Antonio AU - Giordano A AD - Sbarro Institute for Cancer Research and Molecular Medicine, Center for Biotechnology, College of Science and Technology, Temple University, Philadelphia, PA 19122, USA. AD - Department of Medical Biotechnologies, University of Siena, 53100 Siena, Italy. FAU - Paciello, Orlando AU - Paciello O AD - Department of Veterinary Medicine and Animal Production, University of Naples Federico II, Via Federico Delpino, 1, 80137 Napoli, Italy. FAU - D'Ursi, Anna Maria AU - D'Ursi AM AD - Department of Pharmacy, University of Salerno, Via Giovanni Paolo II, 132, 84084 Fisciano, Italy. LA - eng PT - Journal Article DEP - 20240302 PL - Switzerland TA - Life (Basel) JT - Life (Basel, Switzerland) JID - 101580444 PMC - PMC10971392 OTO - NOTNLM OT - MHC OT - coronavirus OT - immunity system OT - peptides COIS- The authors declare no conflicts of interest. EDAT- 2024/03/28 06:45 MHDA- 2024/03/28 06:46 PMCR- 2024/03/02 CRDT- 2024/03/28 01:14 PHST- 2024/01/26 00:00 [received] PHST- 2024/02/26 00:00 [revised] PHST- 2024/02/27 00:00 [accepted] PHST- 2024/03/28 06:46 [medline] PHST- 2024/03/28 06:45 [pubmed] PHST- 2024/03/28 01:14 [entrez] PHST- 2024/03/02 00:00 [pmc-release] AID - life14030334 [pii] AID - life-14-00334 [pii] AID - 10.3390/life14030334 [doi] PST - epublish SO - Life (Basel). 2024 Mar 2;14(3):334. doi: 10.3390/life14030334.