首页> 外国专利> CRYSTAL STRUCTURES OF HUMAN PIM-1 KINASE PROTEIN COMPLEXES AND BINDING POCKETS THEREOF, AND USES THEREOF IN DRUG DESIGN

CRYSTAL STRUCTURES OF HUMAN PIM-1 KINASE PROTEIN COMPLEXES AND BINDING POCKETS THEREOF, AND USES THEREOF IN DRUG DESIGN

机译:人PIM-1激酶蛋白复合物的晶体结构及其结合口袋,并在药物设计中使用

摘要

The present invention relates to the X-ray analysis of crystalline molecules or molecular complexes of human Pim-1. The present invention also relates to Pim-1-like binding pockets. The present invention provides a computer comprising a data storage medium encoded with the structure coordinates of such binding pockets. This invention also relates to methods of using the structure coordinates to solve the structure of homologous proteins or protein complexes. In addition, this invention relates to methods of using the structure coordinates to screen for and design compounds, including inhibitory compounds, that bind to Pim-1 protein, Pim-1 protein complexes, or homologues thereof. The invention also relates to crystallizable compositions and crystals comprising Pim-1 protein, Pim-1 protein complexes with adenosine, staurosporine or 2-(4-morpholinyl)-8-phenyl-4H-l-benzopyran-4-one and methods to produce these crystals.
机译:本发明涉及人Pim-1的结晶分子或分子复合物的X射线分析。本发明还涉及类Pim-1的结合袋。本发明提供了一种计算机,该计算机包括以这种装订袋的结构坐标编码的数据存储介质。本发明还涉及使用结构坐标来解析同源蛋白质或蛋白质复合物的结构的方法。另外,本发明涉及使用结构坐标来筛选和设计与Pim-1蛋白,Pim-1蛋白复合物或其同源物结合的化合物,包括抑制性化合物的方法。本发明还涉及包含Pim-1蛋白,Pim-1蛋白与腺苷,星形孢菌素或2-(4-吗啉基)-8-苯基-4H-1-苯并吡喃-4-酮的Pim-1蛋白复合物的可结晶组合物和晶体及其制备方法。这些晶体。

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