[Chimera-users] Ringer: A program to detect molecular motions by systematic X-ray electron-density sampling
Terry Lang
terry at lego.berkeley.edu
Fri Aug 20 13:41:12 PDT 2010
The Alber lab at UC Berkeley is pleased to release of the code for
Ringer version 1.0 (http://ucxray.berkeley.edu/ringer.htm), which
depends on Chimera. Ringer is a program to detect molecular motions by
systematic X-ray electron-density sampling. The aim of Ringer is to go
beyond static structural snapshots of proteins by uncovering structural
ensembles in X-ray electron density. This information can reveal not
only which parts of proteins are flexible and which parts are rigid, but
it also can define alternate conformations that may be important for
function. Alternate conformations of binding sites also may afford
additional targets for drug design. The Ringer method is described in
Lang et al. /Protein Sci/. 2010 Jul; 19(7):1420-31
<http://www.ncbi.nlm.nih.gov/pubmed/20499387>. An application of
Ringer, determining the structural underpinnings of the side chain
dynamics critical for the function of the enzyme proline isomerase, was
published in Fraser JS et al. /Nature/. 2009 Dec 3;462(7273):669-73
<http://www.ncbi.nlm.nih.gov/pubmed/19956261>. Ringer is freely
available to academics.
--
PaulaTherese Lang
Postdoctoral Scholar
Alber Lab, UC Berkeley
http://ucxray.berkeley.edu/ringer.htm
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