Published January 21, 2009 | Version v1
Journal article

A multi-timescale strength model of alpha-helical protein domains

  • 1. Laboratory for Atomistic and Molecular Mechanics, Department of Civil and Environmental Engineering, Massachusetts Institute of Technology, 77 Massachusetts Avenue Room 1-235A and B, Cambridge, MA (United States)

Description

Here we report a constitutive model that characterizes the strength of an alpha-helical protein domain subjected to tensile deformation, covering more than ten orders of magnitude in timescales. The model elucidates multiple physical mechanisms of failure in dependence on the deformation rate, quantitatively linking atomistic simulation results with experimental strength measurements of alpha-helical protein domains. The model provides a description of the strength of alpha-helices based on fundamental physical parameters such as the H-bond energy and the polypeptide's persistence length, showing that strength is controlled by energetic, nonequilibrium processes at high rates and by thermodynamical, equilibrium processes at low rates. Our model provides a novel perspective on the strength of protein domains at ultra-slow pulling speeds relevant under physiologic and experimental conditions.

Availability note (English)

Available from http://dx.doi.org/10.1088/0953-8984/21/3/035111

Additional details

Identifiers

DOI
10.1088/0953-8984/21/3/035111;
PII
S0953-8984(09)90552-5;

Publishing Information

Journal Title
Journal of Physics. Condensed Matter
Journal Volume
21
Journal Issue
3
Journal Page Range
[6 p.]
ISSN
0953-8984
CODEN
JCOMEL

INIS

Country of Publication
United Kingdom
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
41032527
Subject category
S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
Descriptors DEI
BINDING ENERGY; COVERINGS; DEFORMATION; EQUILIBRIUM; FAILURES; POLYPEPTIDES; PROTEINS; SIMULATION; VELOCITY
Descriptors DEC
ENERGY; ORGANIC COMPOUNDS; PEPTIDES; PROTEINS