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Sequence design of biomimetic copolymers: Modeling of membrane proteins and globular proteins with active enzymatic center

机译:仿生共聚物的序列设计:具有活性酶中心的膜蛋白和球形蛋白的建模

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The biomimetic approach to the sequence design of synthetic AB-copolymers has been developed further by means of new series of Monte Carlo computer simulation. The approach is based on using of some particular conformation of a homopolymer chain for "coloring" of monomeric units into two "colors" (or types) A and B depending on the spatial position of particular monomeric unit. We present recent data of our Monte Carlo computer simulation studies of properties of designed AB-copolymers which mimic membrane proteins, and designed ABC-copolymers which mimic proteins with active enzymatic center. We have found further evidences for the fact that designed copolymer chain preserves the "memory" about its "parent" spatial conformation and shows the well-pronounced tendency to restore main features of the "parent" conformation. [References: 8]
机译:通过新系列的蒙特卡洛计算机模拟,进一步开发了仿生方法,用于合成AB共聚物的序列设计。该方法基于使用均聚物链的某些特定构型,用于根据特定单体单元的空间位置将单体单元“着色”为两种“颜色”(或类型)A和B。我们提供了蒙特卡洛计算机模拟研究的最新数据,这些模拟研究模拟了膜蛋白的设计AB共聚物和模拟具有活性酶中心的蛋白的设计的ABC共聚物。我们发现了以下事实的进一步证据:设计的共聚物链保留了有关其“母体”空间构象的“记忆”,并表现出明显的恢复“母体”构象主要特征的趋势。 [参考:8]

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