FlexServ: an integrated tool for the analysis of protein flexibility

被引:69
作者
Camps, Jordi [1 ,2 ,3 ]
Carrillo, Oliver [1 ,2 ]
Emperador, Agusti [1 ,2 ]
Orellana, Laura [1 ,2 ]
Hospital, Adam [1 ,2 ,3 ]
Rueda, Manuel [1 ,2 ]
Cicin-Sain, Damjan [1 ,2 ,3 ]
D'Abramo, Marco [1 ,2 ,4 ]
Lluis Gelpi, Josep [1 ,2 ,3 ,4 ]
Orozco, Modesto [1 ,2 ,3 ,4 ]
机构
[1] Inst Res Biomed, Joint IRB BSC Program Computat Biol, Barcelona 08028, Spain
[2] Barcelona Supercomp Ctr, Barcelona, Spain
[3] Natl Inst Bioinformat, Barcelona 08034, Spain
[4] Univ Barcelona, Dept Biochem & Mol Biol, E-08028 Barcelona, Spain
关键词
NORMAL-MODE ANALYSIS; ESSENTIAL DYNAMICS;
D O I
10.1093/bioinformatics/btp304
中图分类号
Q5 [生物化学];
学科分类号
071010 ; 081704 ;
摘要
FlexServ is a web-based tool for the analysis of protein flexibility. The server incorporates powerful protocols for the coarse-grained determination of protein dynamics using different versions of Normal Mode Analysis (NMA), Brownian dynamics (BD) and Discrete Dynamics (DMD). It can also analyze user provided trajectories. The server allows a complete analysis of flexibility using a large variety of metrics, including basic geometrical analysis, B-factors, essential dynamics, stiffness analysis, collectivity measures, Lindemann's indexes, residue correlation, chain-correlations, dynamic domain determination, hinge point detections, etc. Data is presented through a web interface as plain text, 2D and 3D graphics.
引用
收藏
页码:1709 / 1710
页数:2
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