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PGfinder, a novel analysis pipeline for the consistent, reproducible and high-resolution structural analysis of bacterial peptidoglycans

Ankur V. Patel, Robert D. Turner, Aline Rifflet, Adelina E. Acosta-Martin, Andrew Nichols, Milena M. Awad, Dena Lyras, View ORCID ProfileIvo Gomperts-Boneca, Marshall Bern, View ORCID ProfileMark O. Collins, View ORCID ProfileStéphane Mesnage
doi: https://doi.org/10.1101/2021.06.01.446515
Ankur V. Patel
1Department of Molecular Biology and Biotechnology, University of Sheffield, Sheffield, United Kingdom
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  • For correspondence: [email protected] [email protected] [email protected]
Robert D. Turner
2Department of Computer Science, University of Sheffield, Sheffield, United Kingdom
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Aline Rifflet
3Institut Pasteur, Unité Biologie et Génétique de la Paroi Bactérienne, Paris, France
4INSERM, Équipe Avenir, Paris
5CNRS, UMR 2001 “Microbiologie intégrative et moléculaire”, Paris, France
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Adelina E. Acosta-Martin
6biOMICS Facility, Faculty of Science Mass Spectrometry Centre, University of Sheffield, Sheffield, United Kingdom
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Andrew Nichols
7Protein Metrics Inc., Cupertino, CA, USA
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Milena M. Awad
8Infection and Immunity Program, Monash Biomedicine Discovery Institute, Clayton, Australia
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Dena Lyras
8Infection and Immunity Program, Monash Biomedicine Discovery Institute, Clayton, Australia
9Department of Microbiology, Monash University, Clayton, Australia
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Ivo Gomperts-Boneca
3Institut Pasteur, Unité Biologie et Génétique de la Paroi Bactérienne, Paris, France
4INSERM, Équipe Avenir, Paris
5CNRS, UMR 2001 “Microbiologie intégrative et moléculaire”, Paris, France
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  • ORCID record for Ivo Gomperts-Boneca
Marshall Bern
7Protein Metrics Inc., Cupertino, CA, USA
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Mark O. Collins
6biOMICS Facility, Faculty of Science Mass Spectrometry Centre, University of Sheffield, Sheffield, United Kingdom
10Department of Biomedical Science, Centre for Membrane Interactions and Dynamics (CMIAD), University of Sheffield, Sheffield, United Kingdom
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Stéphane Mesnage
1Department of Molecular Biology and Biotechnology, University of Sheffield, Sheffield, United Kingdom
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Abstract

Many software solutions are available for proteomics and glycomics studies, but none are ideal for the structural analysis of peptidoglycan, the essential and major component of bacterial cell envelopes. It is comprised of glycan chains and peptide stems, both containing unusual amino acids and sugars. This has forced the field to rely on manual analysis approaches, which are time-consuming, labour-intensive, and prone to error. The lack of automated tools has hampered the ability to perform high-throughput analyses and prevented the adoption of a standard methodology. Here, we describe a novel tool called PGfinder for the analysis of peptidoglycan structure and demonstrate that it represents a powerful tool to quantify PG fragments and discover novel structural features. Our analysis workflow, which relies on open-access tools, is a breakthrough towards a consistent and reproducible analysis of bacterial peptidoglycans. It represents a significant advance towards peptidoglycomics as a full-fledged discipline.

Competing Interest Statement

The authors have declared no competing interest.

Copyright 
The copyright holder for this preprint is the author/funder, who has granted bioRxiv a license to display the preprint in perpetuity. It is made available under a CC-BY 4.0 International license.
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Posted June 01, 2021.
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PGfinder, a novel analysis pipeline for the consistent, reproducible and high-resolution structural analysis of bacterial peptidoglycans
Ankur V. Patel, Robert D. Turner, Aline Rifflet, Adelina E. Acosta-Martin, Andrew Nichols, Milena M. Awad, Dena Lyras, Ivo Gomperts-Boneca, Marshall Bern, Mark O. Collins, Stéphane Mesnage
bioRxiv 2021.06.01.446515; doi: https://doi.org/10.1101/2021.06.01.446515
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PGfinder, a novel analysis pipeline for the consistent, reproducible and high-resolution structural analysis of bacterial peptidoglycans
Ankur V. Patel, Robert D. Turner, Aline Rifflet, Adelina E. Acosta-Martin, Andrew Nichols, Milena M. Awad, Dena Lyras, Ivo Gomperts-Boneca, Marshall Bern, Mark O. Collins, Stéphane Mesnage
bioRxiv 2021.06.01.446515; doi: https://doi.org/10.1101/2021.06.01.446515

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