A deeper insight into the tick salivary protein families under the light of Alphafold2 and Dali : introducing the TickSialoFam 2.0 database
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Date
Authors
Mans, Ben J. (Barend Johannes)
Andersen, John F.
Ribeiro, Jose M.C.
Journal Title
Journal ISSN
Volume Title
Publisher
MDPI
Abstract
Hard ticks feed for several days or weeks on their hosts and their saliva contains thousands of polypeptides belonging to dozens of families, as identified by salivary transcriptomes. Comparison of the coding sequences to protein databases helps to identify putative secreted proteins and their potential functions, directing and focusing future studies, usually done with recombinant proteins that are tested in different bioassays. However, many families of putative secreted peptides have a unique character, not providing significant matches to known sequences. The availability of the Alphafold2 program, which provides in silico predictions of the 3D polypeptide structure, coupled with the Dali program which uses the atomic coordinates of a structural model to search the Protein Data Bank (PDB) allows another layer of investigation to annotate and ascribe a functional role to proteins having so far being characterized as “unique”. In this study, we analyzed the classification of tick salivary proteins under the light of the Alphafold2/Dali programs, detecting novel protein families and gaining new insights relating the structure and function of tick salivary proteins.
Description
SUPPLEMENTARY MATERIALS : (1) SUPPLEMENTAL FIGURES : PowerPoint file with
manuscript figures and movies. (2) SUPPLEMENTAL FILE S1-Disintegrin motifs in prosite format used to scan tick salivary proteins using the program ps_scan.pl Available online: https://github.com/ebi-pf-team/interproscan/blob/master/core/jms-implementation/support-mini-x86-32/bin/prosite/ps_scan.pl. (3) SUPPLEMENTAL SPREADSHEET S1–Hyperlinked spreadsheet containing putative tick salivary proteins linked to comparisons to several databases and AlphaFold predicted structures. Clusterization of the proteins allowed for extraction of reversed-position specific motifs collected into the TSFam 2.0 database. The spreadsheet has links to pdb files, which need programs that are able to open them. We suggest the use of ChimeraX Available online: https://www.cgl.ucsf.edu/chimerax/
download.html) or Swiss-PDBViewer Available online: https://spdbv.unil.ch/. (4) Supplementary TickSialoFam 2.0 database–Include RPS models and a formatted database which should be used to query protein sequences by means of the rpsblast program from the NCBI Blast suite of programs
Available online: https://ftp.ncbi.nlm.nih.gov/blast/executables/blast+/LATEST/.
DATA AVAILABILITY STATEMENT : Publicly available datasets were analyzed in this study. This data can be found here: https://proj-bip-prod-publicread.s3.amazonaws.com/transcriptome/TickSialoFam/ TSF2.0/SupSpreadsheet+1.xlsx.
DATA AVAILABILITY STATEMENT : Publicly available datasets were analyzed in this study. This data can be found here: https://proj-bip-prod-publicread.s3.amazonaws.com/transcriptome/TickSialoFam/ TSF2.0/SupSpreadsheet+1.xlsx.
Keywords
Medical entomology, Ticks, Salivary gland, Structure, Classification
Sustainable Development Goals
Citation
Mans, B.J.; Andersen, J.F.; Ribeiro, J.M.C. A Deeper Insight into the Tick Salivary Protein Families under the Light of Alphafold2 and Dali: Introducing the TickSialoFam 2.0 Database. International Journal of Molecular Sciences 2022, 23, 15613. https://doi.org/10.3390/ijms232415613.