论文部分内容阅读
借助人白介素６的核磁共振构象，以人生长因子受体为模板同源模建的人白 介素６受体空间构象，通过表观静电势分析，结合空间构象的互补性对人白介素６与其 受体进行分子对接，在分子力学优化、分子动力学动态模拟的基础上获得稳定的复合物 结构，从理论上预测人白介素６与其受体相互作用的结构域，进一步确定影响人白介素 ６与其受体相互作用的特定位点，为确定靶蛋白人白介素６的活性部位、利用计算机寻 找和辅助设计新的拮抗剂提供理论依据．
With human nuclear interleukin 6 conformation, human growth factor receptor as a template homology modeling of human interleukin 6 receptor spatial conformation, by electrostatic potential analysis, combined with the complementary spatial conformation of human interleukin 6 and its receptor Molecular docking, in molecular mechanics optimization, dynamic simulation of molecular dynamics to obtain a stable complex structure, theoretically predicted human interleukin 6 and its receptor interaction domain, to further determine the impact of human interleukin 6 and its receptor mutual In order to determine the active site of target human interleukin-6, a computer-based search for and assistance in the design of new antagonists provides a theoretical basis.