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Unfolding times for proteins in a force clamp

Luccioli, Stefano ; Imparato, Alberto ; Mitternacht, Simon LU ; Irbäck, Anders LU orcid and Torcini, Alessandro (2010) In Physical Review E (Statistical, Nonlinear, and Soft Matter Physics) 81(1).
Abstract
The escape process from the native valley for proteins subjected to a constant stretching force is examined using a model for a beta barrel. For a wide range of forces, the unfolding dynamics can be treated as one-dimensional diffusion, parametrized in terms of the end-to-end distance. In particular, the escape times can be evaluated as first passage times for a Brownian particle moving on the protein free-energy landscape, using the Smoluchowski equation. At strong forces, the unfolding process can be viewed as a diffusive drift away from the native state, while at weak forces thermal activation is the relevant mechanism. An escape-time analysis within this approach reveals a crossover from an exponential to an inverse Gaussian... (More)
The escape process from the native valley for proteins subjected to a constant stretching force is examined using a model for a beta barrel. For a wide range of forces, the unfolding dynamics can be treated as one-dimensional diffusion, parametrized in terms of the end-to-end distance. In particular, the escape times can be evaluated as first passage times for a Brownian particle moving on the protein free-energy landscape, using the Smoluchowski equation. At strong forces, the unfolding process can be viewed as a diffusive drift away from the native state, while at weak forces thermal activation is the relevant mechanism. An escape-time analysis within this approach reveals a crossover from an exponential to an inverse Gaussian escape-time distribution upon passing from weak to strong forces. Moreover, a single expression valid at weak and strong forces can be devised both for the average unfolding time as well as for the corresponding variance. The analysis offers a possible explanation of recent experimental findings for the proteins ddFLN4 and ubiquitin. (Less)
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author
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organization
publishing date
type
Contribution to journal
publication status
published
subject
in
Physical Review E (Statistical, Nonlinear, and Soft Matter Physics)
volume
81
issue
1
article number
010902
publisher
American Physical Society
external identifiers
  • wos:000277186100003
  • scopus:76349091603
  • pmid:20365316
ISSN
1539-3755
DOI
10.1103/PhysRevE.81.010902
language
English
LU publication?
yes
id
fbe58c02-4b1d-48c3-8403-ac9f5b9ac5ed (old id 1601083)
date added to LUP
2016-04-01 11:14:16
date last changed
2024-01-07 10:59:39
@article{fbe58c02-4b1d-48c3-8403-ac9f5b9ac5ed,
  abstract     = {{The escape process from the native valley for proteins subjected to a constant stretching force is examined using a model for a beta barrel. For a wide range of forces, the unfolding dynamics can be treated as one-dimensional diffusion, parametrized in terms of the end-to-end distance. In particular, the escape times can be evaluated as first passage times for a Brownian particle moving on the protein free-energy landscape, using the Smoluchowski equation. At strong forces, the unfolding process can be viewed as a diffusive drift away from the native state, while at weak forces thermal activation is the relevant mechanism. An escape-time analysis within this approach reveals a crossover from an exponential to an inverse Gaussian escape-time distribution upon passing from weak to strong forces. Moreover, a single expression valid at weak and strong forces can be devised both for the average unfolding time as well as for the corresponding variance. The analysis offers a possible explanation of recent experimental findings for the proteins ddFLN4 and ubiquitin.}},
  author       = {{Luccioli, Stefano and Imparato, Alberto and Mitternacht, Simon and Irbäck, Anders and Torcini, Alessandro}},
  issn         = {{1539-3755}},
  language     = {{eng}},
  number       = {{1}},
  publisher    = {{American Physical Society}},
  series       = {{Physical Review E (Statistical, Nonlinear, and Soft Matter Physics)}},
  title        = {{Unfolding times for proteins in a force clamp}},
  url          = {{http://dx.doi.org/10.1103/PhysRevE.81.010902}},
  doi          = {{10.1103/PhysRevE.81.010902}},
  volume       = {{81}},
  year         = {{2010}},
}