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PreBI:晶体中蛋白质生物界面的预测

PreBI: prediction of biological interfaces of proteins in crystals.

作者信息

Tsuchiya Yuko, Kinoshita Kengo, Ito Nobutoshi, Nakamura Haruki

机构信息

Institute for Protein Research, Osaka University, 3-2 Yamadaoka, Suita, Osaka, 565-0871, Japan.

出版信息

Nucleic Acids Res. 2006 Jul 1;34(Web Server issue):W320-4. doi: 10.1093/nar/gkl267.

Abstract

PreBI is a server that predicts biological interfaces in protein crystal structures, according to the complementarity and the area of the interface. The server accepts a coordinate file in the PDB format, and all of the possible interfaces are generated automatically, according to the symmetry operations given in the coordinate file. For all of the interfaces generated, the complementarities of the electrostatic potential, hydrophobicity and shape of the interfaces are analyzed, and the most probable biological interface is identified according to the combination of the degree of complementarity derived from the database analyses and the area of the interface. The results can be checked through an interactive viewer, and the most probable complex can be downloaded as atomic coordinates in the PDB format. PreBI is available at http://pre-s.protein.osaka-u.ac.jp/~prebi/.

摘要

PreBI是一个根据界面的互补性和面积预测蛋白质晶体结构中生物界面的服务器。该服务器接受PDB格式的坐标文件,并根据坐标文件中给出的对称操作自动生成所有可能的界面。对于生成的所有界面,分析其静电势、疏水性和形状的互补性,并根据数据库分析得出的互补程度和界面面积的组合确定最可能的生物界面。结果可通过交互式查看器进行检查,最可能的复合物可作为PDB格式的原子坐标下载。可通过http://pre-s.protein.osaka-u.ac.jp/~prebi/访问PreBI。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3c5a/1538861/7efd4d23c6f1/gkl267f1.jpg

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