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首页> 外文期刊>Journal of Medicinal Chemistry >Development of a Three-Dimensional Model for the N-Methyl-D-aspartate NR2A Subunit
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Development of a Three-Dimensional Model for the N-Methyl-D-aspartate NR2A Subunit

机译:N-甲基-D-天冬氨酸NR2A亚基三维模型的开发

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摘要

NR2 subunits of N-methyl-D-aspartic acid (NMDA) receptors are known to bind the neurotrans-mitter glutamate,competitive agonists,and antagonists.Since crystallographic data of these proteins are not available,we built a homology model of the ligand binding domain of the NR2A subunit.A consensus binding mode of selected AP5-like NMDA antagonists has been ascertained using molecular docking.The present 3D model gives insights for the design of new NMDA subtype selective compounds.
机译:已知N-甲基-D-天冬氨酸(NMDA)受体的NR2亚基结合神经递质谷氨酸,竞争性激动剂和拮抗剂。由于无法获得这些蛋白质的晶体学数据,我们建立了配体结合的同源性模型使用分子对接确定了AP5类NMDA拮抗剂的共识结合模式。目前的3D模型为新型NMDA亚型选择性化合物的设计提供了见识。

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