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纳米毛虫的随机游动:通过配体-受体接触进行扩散。

The nanocaterpillar's random walk: diffusion with ligand-receptor contacts.

作者信息

Marbach Sophie, Zheng Jeana Aojie, Holmes-Cerfon Miranda

机构信息

Courant Institute of Mathematical Sciences, New York University, NY, 10012, USA.

CNRS, Sorbonne Université, Physicochimie des Electrolytes et Nanosystèmes Interfaciaux, F-75005 Paris, France.

出版信息

Soft Matter. 2022 Apr 20;18(16):3130-3146. doi: 10.1039/d1sm01544c.

Abstract

Particles with ligand-receptor contacts bind and unbind fluctuating "legs" to surfaces, whose fluctuations cause the particle to diffuse. Quantifying the diffusion of such "nanoscale caterpillars" is a challenge, since binding events often occur on very short time and length scales. Here we derive an analytical formula, validated by simulations, for the long time translational diffusion coefficient of an overdamped nanocaterpillar, under a range of modeling assumptions. We demonstrate that the effective diffusion coefficient, which depends on the microscopic parameters governing the legs, can be orders of magnitude smaller than the background diffusion coefficient. Furthermore it varies rapidly with temperature, and reproduces the striking variations seen in existing data and our own measurements of the diffusion of DNA-coated colloids. Our model gives insight into the mechanism of motion, and allows us to ask: when does a nanocaterpillar prefer to move by sliding, where one leg is always linked to the surface, and when does it prefer to move by hopping, which requires all legs to unbind simultaneously? We compare a range of systems (viruses, molecular motors, white blood cells, protein cargos in the nuclear pore complex, bacteria such as , and DNA-coated colloids) and present guidelines to control the mode of motion for materials design.

摘要

具有配体 - 受体接触的粒子与表面结合并解开波动的“腿”,表面的波动导致粒子扩散。量化这种“纳米级毛虫”的扩散是一项挑战,因为结合事件通常发生在非常短的时间和长度尺度上。在这里,我们在一系列建模假设下,推导出一个经过模拟验证的、关于过阻尼纳米毛虫长时间平移扩散系数的解析公式。我们证明,取决于控制腿部的微观参数的有效扩散系数,可能比背景扩散系数小几个数量级。此外,它随温度迅速变化,并再现了现有数据以及我们自己对 DNA 包覆胶体扩散测量中所观察到的显著变化。我们的模型深入了解了运动机制,并使我们能够提出问题:纳米毛虫何时更倾向于通过滑动移动(此时一条腿始终与表面相连),何时更倾向于通过跳跃移动(这需要所有腿同时解开)?我们比较了一系列系统(病毒、分子马达、白细胞、核孔复合物中的蛋白质货物、诸如……的细菌以及 DNA 包覆胶体),并给出了用于材料设计中控制运动模式的指导方针。

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