Efficient rebuilding of protein structures
Efficient rebuilding of protein structures
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DOI：
10.1107/s0907444996001783
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发表时间：
1996-07-01
期刊：
影响因子：
--
通讯作者：
Jones, TA
中科院分区：
文献类型：
--
作者：
Kleywegt, GJ;Jones, TA
描述了一种称为OOPS的计算机程序，该程序促进并加快了在其电子密度内重建蛋白质结构的过程，并减少了在整个晶体学蛋白质结构测定过程中持续存在局部错误的机会。该程序使用一组标准来判断每个蛋白质残基的合理性，并且它为大分子晶体学模型构建程序O生成宏[Jones，Zou，科万& Kjeldgaard（1991）。Acta Cryst. A47，110-119]，当执行时，将带晶体学家沿着所有可疑残留物进行沿着旅行。
A computer program, called OOPS, is described which facilitates and speeds up the process of rebuilding a protein structure inside its electron density and reduces the chances of local errors persevering throughout the crystallographic protein structure determination process. The program uses a set of criteria to judge how reasonable each protein residue is and it generates macros for the macromolecular crystallographic model-building program O [Jones, Zou, Cowan & Kjeldgaard (1991). Acta Cryst. A47, 110-119] which, when executed, will take the crystallographer on a journey along all suspect residues.