SABA (secondary structure assignment program based on only alpha carbons): a novel pseudo center geometrical criterion for accurate assignment of protein secondary structures
- Authors
- Park, Sang Youn; Yoo, Min-Jae; Shin, Jaemin; Cho, Kwang-Hwi
- Issue Date
- 28-Feb-2011
- Publisher
- KOREAN SOCIETY BIOCHEMISTRY & MOLECULAR BIOLOGY
- Keywords
- alpha-helix; beta-strand; Pseudo center; Secondary structure identification; 3(10)-helix
- Citation
- BMB REPORTS, v.44, no.2, pp.118 - 122
- Journal Title
- BMB REPORTS
- Volume
- 44
- Number
- 2
- Start Page
- 118
- End Page
- 122
- URI
- http://scholarworks.bwise.kr/ssu/handle/2018.sw.ssu/13722
- DOI
- 10.5483/BMBRep.2011.44.2.118
- ISSN
- 1976-6696
- Abstract
- Most widely used secondary structure assignment methods such as DSSP identify structural elements based on N-H and C=O hydrogen bonding patterns from X-ray or NMR-determined coordinates. Secondary structure assignment algorithms using limited C alpha information have been under development as well, but their accuracy is only similar to 80% compared to DSSP. We have hereby developed SABA (Secondary Structure Assignment Program Based on only Alpha Carbons) with similar to 90% accuracy. SABA defines a novel geometrical parameter, termed a pseudo center, which is the midpoint of two continuous C alpha s. SABA is capable of identifying alpha-helices, 3(10)-helices, and beta-strands with high accuracy by using cut-off criteria on distances and dihedral angles between two or more pseudo centers. In addition to assigning secondary structures to C alpha-only structures, algorithms using limited C alpha information with high accuracy have the potential to enhance the speed of calculations for high capacity structure comparison. [BMB reports 2011; 44(2): 118-122]
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