Observation of Aerosolization-induced Morphological Changes in Viral Capsids

Fuente: arXiv
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Main Authors: Mall, Abhishek, Munke, Anna, Shen, Zhou, Mazumder, Parichita, Bielecki, Johan, E, Juncheng, Estillore, Armando, Kim, Chan, Letrun, Romain, Lübke, Jannik, Rafie-Zinedine, Safi, Round, Adam, Round, Ekaterina, Rütten, Michael, Samanta, Amit K., Sarma, Abhisakh, Sato, Tokushi, Schulz, Florian, Seuring, Carolin, Wollweber, Tamme, Worbs, Lena, Vagovic, Patrik, Bean, Richard, Mancuso, Adrian P., Loh, Ne-Te Duane, Beck, Tobias, Küpper, Jochen, Maia, Filipe R. N. C., Chapman, Henry N., Ayyer, Kartik
Format: Preprint
Published: 2024
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author Mall, Abhishek
Munke, Anna
Shen, Zhou
Mazumder, Parichita
Bielecki, Johan
E, Juncheng
Estillore, Armando
Kim, Chan
Letrun, Romain
Lübke, Jannik
Rafie-Zinedine, Safi
Round, Adam
Round, Ekaterina
Rütten, Michael
Samanta, Amit K.
Sarma, Abhisakh
Sato, Tokushi
Schulz, Florian
Seuring, Carolin
Wollweber, Tamme
Worbs, Lena
Vagovic, Patrik
Bean, Richard
Mancuso, Adrian P.
Loh, Ne-Te Duane
Beck, Tobias
Küpper, Jochen
Maia, Filipe R. N. C.
Chapman, Henry N.
Ayyer, Kartik
author_facet Mall, Abhishek
Munke, Anna
Shen, Zhou
Mazumder, Parichita
Bielecki, Johan
E, Juncheng
Estillore, Armando
Kim, Chan
Letrun, Romain
Lübke, Jannik
Rafie-Zinedine, Safi
Round, Adam
Round, Ekaterina
Rütten, Michael
Samanta, Amit K.
Sarma, Abhisakh
Sato, Tokushi
Schulz, Florian
Seuring, Carolin
Wollweber, Tamme
Worbs, Lena
Vagovic, Patrik
Bean, Richard
Mancuso, Adrian P.
Loh, Ne-Te Duane
Beck, Tobias
Küpper, Jochen
Maia, Filipe R. N. C.
Chapman, Henry N.
Ayyer, Kartik
contents Single-stranded RNA viruses co-assemble their capsid with the genome and variations in capsid structures can have significant functional relevance. In particular, viruses need to respond to a dehydrating environment to prevent genomic degradation and remain active upon rehydration. Theoretical work has predicted low-energy buckling transitions in icosahedral capsids which could protect the virus from further dehydration. However, there has been no direct experimental evidence, nor molecular mechanism, for such behaviour. Here we observe this transition using X-ray single particle imaging of MS2 bacteriophages after aerosolization. Using a combination of machine learning tools, we classify hundreds of thousands of single particle diffraction patterns to learn the structural landscape of the capsid morphology as a function of time spent in the aerosol phase. We found a previously unreported compact conformation as well as intermediate structures which suggest an incoherent buckling transition which does not preserve icosahedral symmetry. Finally, we propose a mechanism of this buckling, where a single 19-residue loop is destabilised, leading to the large observed morphology change. Our results provide experimental evidence for a mechanism by which viral capsids protect themselves from dehydration. In the process, these findings also demonstrate the power of single particle X-ray imaging and machine learning methods in studying biomolecular structural dynamics.
format Preprint
id arxiv_https___arxiv_org_abs_2407_11687
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Observation of Aerosolization-induced Morphological Changes in Viral Capsids
Mall, Abhishek
Munke, Anna
Shen, Zhou
Mazumder, Parichita
Bielecki, Johan
E, Juncheng
Estillore, Armando
Kim, Chan
Letrun, Romain
Lübke, Jannik
Rafie-Zinedine, Safi
Round, Adam
Round, Ekaterina
Rütten, Michael
Samanta, Amit K.
Sarma, Abhisakh
Sato, Tokushi
Schulz, Florian
Seuring, Carolin
Wollweber, Tamme
Worbs, Lena
Vagovic, Patrik
Bean, Richard
Mancuso, Adrian P.
Loh, Ne-Te Duane
Beck, Tobias
Küpper, Jochen
Maia, Filipe R. N. C.
Chapman, Henry N.
Ayyer, Kartik
Biomolecules
Image and Video Processing
Single-stranded RNA viruses co-assemble their capsid with the genome and variations in capsid structures can have significant functional relevance. In particular, viruses need to respond to a dehydrating environment to prevent genomic degradation and remain active upon rehydration. Theoretical work has predicted low-energy buckling transitions in icosahedral capsids which could protect the virus from further dehydration. However, there has been no direct experimental evidence, nor molecular mechanism, for such behaviour. Here we observe this transition using X-ray single particle imaging of MS2 bacteriophages after aerosolization. Using a combination of machine learning tools, we classify hundreds of thousands of single particle diffraction patterns to learn the structural landscape of the capsid morphology as a function of time spent in the aerosol phase. We found a previously unreported compact conformation as well as intermediate structures which suggest an incoherent buckling transition which does not preserve icosahedral symmetry. Finally, we propose a mechanism of this buckling, where a single 19-residue loop is destabilised, leading to the large observed morphology change. Our results provide experimental evidence for a mechanism by which viral capsids protect themselves from dehydration. In the process, these findings also demonstrate the power of single particle X-ray imaging and machine learning methods in studying biomolecular structural dynamics.
title Observation of Aerosolization-induced Morphological Changes in Viral Capsids
topic Biomolecules
Image and Video Processing
url https://arxiv.org/abs/2407.11687