Ontology highlight
ABSTRACT:
SUBMITTER: Marai CNj
PROVIDER: S-EPMC2851665 | biostudies-literature | 2010 Mar
REPOSITORIES: biostudies-literature
Marai Christopher Nj CNj Mukamel Shaul S Wang Jin J
PMC biophysics 20100319 1
We propose to use infrared coherent two-dimensional correlation spectroscopy (2DCS) to characterize the folding mechanism of the mini-protein Beta3s. In this study Beta3s was folded by molecular dynamics (MD) simulation and intermediate conformational ensembles were identified. The one and two-dimensional correlation spectrum was calculated for the intermediate and native states of the mini-protein. A direct structure-spectra relationship was determined by analysis of conformational properties a ...[more]