AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION

CASP (Critical Assessment of protein Structure Prediction) is a community-wide experiment for protein structure prediction taking place every two years since 1994. In CASP11 held in 2014, according to the official CASP11 assessment, our method named `nns' was ranked as the second best server m...

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Main Authors: KEEHYOUNG JOO, INSUK JOUNG, JOOYOUNG LEE
Format: Article
Language:English
Published: Gdańsk University of Technology 2016-10-01
Series:TASK Quarterly
Subjects:
Online Access:https://journal.mostwiedzy.pl/TASKQuarterly/article/view/1824
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author KEEHYOUNG JOO
INSUK JOUNG
JOOYOUNG LEE
author_facet KEEHYOUNG JOO
INSUK JOUNG
JOOYOUNG LEE
author_sort KEEHYOUNG JOO
collection DOAJ
description CASP (Critical Assessment of protein Structure Prediction) is a community-wide experiment for protein structure prediction taking place every two years since 1994. In CASP11 held in 2014, according to the official CASP11 assessment, our method named `nns' was ranked as the second best server method based on models ranked as first out of 81 targets. In `nns', we applied the powerful global optimization method of conformational space annealing to three stages of optimization, including multiple sequence-structure alignment, three-dimensional (3D) chain building, and side-chain remodeling. For the fold recognition, a new alignment method called CRFalign was used. The good performance of the nns server method is attributed to the successful fold recognition carried out by combined methods including CRFalign, and the current modeling formulation incorporating accurate structural aspects collected from multiple templates. In this article, we provide a successful example of `nns' predictions for T0776, for which all details of intermediate modeling data are provided.
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spelling doaj.art-ef5f8fe15a75443d974c6b2d2862f2412022-12-22T02:24:24ZengGdańsk University of TechnologyTASK Quarterly1428-63942016-10-0120410.17466/tq2016/20.4/bAN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATIONKEEHYOUNG JOO0INSUK JOUNG1JOOYOUNG LEE2Center for In Silico Protein Science, Center for Advanced ComputationKorea Institute for Advanced Study, Center for In Silico Protein Science, School of Computational SciencesKorea Institute for Advanced Study, Center for In Silico Protein Science, Center for Advanced Computation, School of Computational Sciences CASP (Critical Assessment of protein Structure Prediction) is a community-wide experiment for protein structure prediction taking place every two years since 1994. In CASP11 held in 2014, according to the official CASP11 assessment, our method named `nns' was ranked as the second best server method based on models ranked as first out of 81 targets. In `nns', we applied the powerful global optimization method of conformational space annealing to three stages of optimization, including multiple sequence-structure alignment, three-dimensional (3D) chain building, and side-chain remodeling. For the fold recognition, a new alignment method called CRFalign was used. The good performance of the nns server method is attributed to the successful fold recognition carried out by combined methods including CRFalign, and the current modeling formulation incorporating accurate structural aspects collected from multiple templates. In this article, we provide a successful example of `nns' predictions for T0776, for which all details of intermediate modeling data are provided. https://journal.mostwiedzy.pl/TASKQuarterly/article/view/1824template based modelingprotein structure modelingglobal optimizationcasphomology modelingsequence alignment
spellingShingle KEEHYOUNG JOO
INSUK JOUNG
JOOYOUNG LEE
AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
TASK Quarterly
template based modeling
protein structure modeling
global optimization
casp
homology modeling
sequence alignment
title AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
title_full AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
title_fullStr AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
title_full_unstemmed AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
title_short AN EXAMPLE OF TEMPLATE BASED PROTEIN STRUCTURE MODELING BY GLOBAL OPTIMIZATION
title_sort example of template based protein structure modeling by global optimization
topic template based modeling
protein structure modeling
global optimization
casp
homology modeling
sequence alignment
url https://journal.mostwiedzy.pl/TASKQuarterly/article/view/1824
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