Title :
Alpha helix prediction based on Metropolis-Hastings sampling
Author :
Ma, Lingyu ; Reisert, Marco ; Wirth, Christophe ; Hunte, Carola ; Ronneberger, Olaf ; Burkhardt, Hans
Author_Institution :
Dept. of Comput. Sci., Univ. of Freiburg, Freiburg, Germany
fDate :
March 30 2011-April 2 2011
Abstract :
Accurate identification of protein secondary structures is beneficial to the structural interpretation of low-resolution X-ray and EM electron density maps. Existing alpha helix identification methods mainly focus on locally voxelwise classification and then link the helix-voxels based on post-processing processes. In this paper, a novel alpha helix identification approach, named as SSEPredictor, based on Metropolis-Hastings sampling is proposed, which can provide both locally and globally optimized prediction for alpha helical structures in low-resolution electron density maps. The approach has been tested on X-ray crystallographic electron density maps at 8Å resolution. The experimental results show that the identification accuracy is promising.
Keywords :
X-ray crystallography; biology computing; molecular biophysics; molecular configurations; prediction theory; proteins; sampling methods; EM electron density maps; Metropolis-Hastings sampling; SSEPredictor; X-ray crystallographic electron density maps; alpha helix prediction; globally optimized prediction; locally optimized prediction; low-resolution X-ray maps; protein secondary structures; voxelwise classification; Crystallography; Image segmentation; Proposals; Proteins; Tensile stress; Tin; Metropolis-Hastings sampling; low-resolution X-ray crystallographic data; secondary structure identification; steerable filters;
Conference_Titel :
Biomedical Imaging: From Nano to Macro, 2011 IEEE International Symposium on
Conference_Location :
Chicago, IL
Print_ISBN :
978-1-4244-4127-3
Electronic_ISBN :
1945-7928
DOI :
10.1109/ISBI.2011.5872790