Hu Zhang-Hu, Lv Wen-Ping, Hui De-Xuan, Wang Xiao-Juan, Wang You-Nian
School of Physics, Dalian University of Technology, Dalian 116024, People's Republic of China.
Warshel Institute for Computational Biology, School of Life and Health Sciences, The Chinese University of Hong Kong, Shenzhen, Guangdong 518172, People's Republic of China.
Phys Rev E. 2022 Feb;105(2-1):024104. doi: 10.1103/PhysRevE.105.024104.
Potassium ion channels are essential elements in cellular electrical excitability and help maintain a resting potential in nonexcitable cells. Their universality is based on a unique combination of strong selectivity for K^{+} ions and near-diffusion-limited permeation efficiency. Understanding how the channel regulates the ion conduction would be instructive to the treatment of ion channelopathies. In this work, by means of molecular dynamics simulations, we demonstrate the significantly enhanced permeation of KcsA channel in reaction to an external terahertz wave, due to the effective response of the K^{+} ions in the selectivity filter regions of the channel. Compared to the case without external terahertz wave, a fourfold increase in the ion current through the channel is found.
钾离子通道是细胞电兴奋性的基本要素,有助于维持非兴奋性细胞的静息电位。它们的普遍性基于对K⁺离子的强选择性和近乎扩散限制的渗透效率这一独特组合。了解通道如何调节离子传导对于离子通道病的治疗具有指导意义。在这项工作中,通过分子动力学模拟,我们证明了由于通道选择性过滤器区域中K⁺离子的有效响应,KcsA通道在外部太赫兹波作用下渗透显著增强。与没有外部太赫兹波的情况相比,发现通过该通道的离子电流增加了四倍。