Lawson Catherine L, Dutta Shuchismita, Westbrook John D, Henrick Kim, Berman Helen M
RCSB Protein Data Bank, Department of Chemistry and Chemical Biology, Rutgers, The State University of New Jersey, 610 Taylor Road, Piscataway, NJ 08854-8087, USA.
Acta Crystallogr D Biol Crystallogr. 2008 Aug;D64(Pt 8):874-82. doi: 10.1107/S0907444908017393. Epub 2008 Jul 17.
A new scheme has been devised to represent viruses and other biological assemblies with regular noncrystallographic symmetry in the Protein Data Bank (PDB). The scheme describes existing and anticipated PDB entries of this type using generalized descriptions of deposited and experimental coordinate frames, symmetry and frame transformations. A simplified notation has been adopted to express the symmetry generation of assemblies from deposited coordinates and matrix operations describing the required point, helical or crystallographic symmetry. Complete correct information for building full assemblies, subassemblies and crystal asymmetric units of all virus entries is now available in the remediated PDB archive.
已经设计出一种新方案,用于在蛋白质数据库(PDB)中表示具有规则非晶体学对称性的病毒和其他生物组装体。该方案使用对存入的和实验坐标框架、对称性及框架变换的通用描述,来描述此类现有的和预期的PDB条目。已采用一种简化表示法,以从存入的坐标和描述所需点、螺旋或晶体对称性的矩阵运算来表达组装体的对称性生成。现在,在经过修复的PDB存档中可获得用于构建所有病毒条目的完整组装体、子组装体和晶体不对称单元的完整正确信息。