Protein-protein docking benchmark 2.0: An update

被引:227
作者
Mintseris, J
Wiehe, K
Pierce, B
Anderson, R
Chen, R
Janin, J
Weng, ZP
机构
[1] Boston Univ, Dept Biomed Engn, Boston, MA 02215 USA
[2] Boston Univ, Bioinformat Program, Boston, MA 02215 USA
[3] Lab Enzymol & Biochim Struct, Gif Sur Yvette, France
关键词
protein-protein docking; protein complexes; protein-protein interactions; complex structure;
D O I
10.1002/prot.20560
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
We present a new version of the Protein-Protein Docking Benchmark, reconstructed from the bottom up to include more complexes, particularly focusing on more unbound-unbound test cases. SCOP (Structural Classification of Proteins) Was used to assess redundancy between the complexes in this version. The new benchmark consists of 72 unbound-unbound cases, with 52 rigid-body cases, 13 medium-difficulty cases, and 7 high-difficulty cases with substantial conformational change. In addition, we retained 12 antibody-antigen test cases with the antibody structure in the bound form. The new benchmark provides a platform for evaluating the progress of docking methods on a wide variety of targets. The new version of the benchmark is available to the public at http://zlab.bu.edu/benchmark2. (c) 2005 Wiley-Liss,Inc.
引用
收藏
页码:214 / 216
页数:3
相关论文
共 50 条
  • [41] Complex-type-dependent scoring functions in protein-protein docking
    Li, Chun Hua
    Ma, Xiao Hui
    Shen, Long Zhu
    Chang, Shan
    Chen, Wei Zu
    Wang, Cun Xin
    BIOPHYSICAL CHEMISTRY, 2007, 129 (01) : 1 - 10
  • [42] An analysis of conformational changes on protein-protein association: implications for predictive docking
    Betts, MJ
    Sternberg, MJE
    PROTEIN ENGINEERING, 1999, 12 (04): : 271 - 283
  • [43] Surface-histogram: A new shape descriptor for protein-protein docking
    Gu, Shengyin
    Koehl, Patrice
    Hass, Joel
    Amenta, Nina
    PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2012, 80 (01) : 221 - 238
  • [44] Protein-protein Docking and Hot-spot Prediction for Drug Discovery
    Grosdidier, Solene
    Fernandez-Recio, Juan
    CURRENT PHARMACEUTICAL DESIGN, 2012, 18 (30) : 4607 - 4618
  • [45] F2Dock: Fast Fourier Protein-Protein Docking
    Bajaj, Chandrajit
    Chowdhury, Rezaul
    Siddavanahalli, Vinay
    IEEE-ACM TRANSACTIONS ON COMPUTATIONAL BIOLOGY AND BIOINFORMATICS, 2011, 8 (01) : 45 - 58
  • [46] Parameter tuning and evaluation of an affinity prediction using protein-protein docking
    Yoshikawa, T.
    Tsukamoto, K.
    Hourai, Y.
    Fukui, K.
    MMACTEE' 08: PROCEEDINGS OF THE 10TH WSEAS INTERNATIONAL CONFERENCE MATHERMATICAL METHODS AND COMPUTATIONAL TECHNIQUES IN ELECTRICAL ENGINEERING: COMPUTATIONAL METHODS AND INTELLIGENT SYSTEMS, 2008, : 312 - 317
  • [47] Predicting molecular interactions in silico:: II.: Protein-protein and protein-drug docking
    Schneidman-Duhovny, D
    Nussinov, R
    Wolfson, HJ
    CURRENT MEDICINAL CHEMISTRY, 2004, 11 (01) : 91 - 107
  • [48] Automatic prediction of flexible regions improves the accuracy of protein-protein docking models
    Xiaohu Luo
    Qiang Lü
    Hongjie Wu
    Lingyun Yang
    Xu Huang
    Peide Qian
    Gang Fu
    Journal of Molecular Modeling, 2012, 18 : 2199 - 2208
  • [49] Computational study for protein-protein docking using global optimization and empirical potentials
    Lee, Kyoungrim
    INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2008, 9 (01) : 65 - 77
  • [50] LZerD Protein-Protein Docking Webserver Enhanced With de novo Structure Prediction
    Christoffer, Charles
    Bharadwaj, Vijay
    Luu, Ryan
    Kihara, Daisuke
    FRONTIERS IN MOLECULAR BIOSCIENCES, 2021, 8