Alimohamadi Haleh, de Anda Jaime, Lee Michelle W, Schmidt Nathan W, Mandal Taraknath, Wong Gerard C L
bioRxiv. 2023 Jul 27:2023.07.26.550729. doi: 10.1101/2023.07.26.550729.
Peptide induced trans-membrane pore formation is commonplace in biology. Examples of transmembrane pores include pores formed by antimicrobial peptides (AMPs) and cell penetrating peptides (CPPs) in bacterial membranes and eukaryotic membranes, respectively. In general, however, transmembrane pore formation depends on peptide sequences, lipid compositions and intensive thermodynamic variables and is difficult to observe directly under realistic solution conditions, with structures that are challenging to measure directly. In contrast, the structure and phase behavior of peptide-lipid systems are relatively straightforward to map out experimentally for a broad range of conditions. Cubic phases are often observed in systems involving pore forming peptides; however, it is not clear how the structural tendency to induce negative Gaussian curvature (NGC) in such phases is quantitatively related to the geometry of biological pores. Here, we leverage the theory of anisotropic inclusions and devise a facile method to estimate transmembrane pore sizes from geometric parameters of cubic phases measured from small angle X-ray scattering (SAXS) and show that such estimates compare well with known pore sizes. Moreover, our model suggests that whereas AMPs can induce stable transmembrane pores for membranes with a broad range of conditions, pores formed by CPPs are highly labile, consistent with atomistic simulations.
肽诱导的跨膜孔形成在生物学中很常见。跨膜孔的例子包括抗菌肽(AMPs)和细胞穿透肽(CPPs)分别在细菌膜和真核细胞膜中形成的孔。然而,一般来说,跨膜孔的形成取决于肽序列、脂质组成和强烈的热力学变量,并且在实际溶液条件下很难直接观察到,其结构也难以直接测量。相比之下,肽-脂质系统的结构和相行为在广泛的条件下通过实验相对容易确定。在涉及成孔肽的系统中经常观察到立方相;然而,尚不清楚在这些相中诱导负高斯曲率(NGC)的结构倾向与生物孔的几何形状如何定量相关。在这里,我们利用各向异性内含物理论,设计了一种简便的方法,从小角X射线散射(SAXS)测量的立方相几何参数估计跨膜孔的大小,并表明这些估计值与已知孔大小比较吻合。此外,我们的模型表明,虽然AMPs可以在广泛的条件下为膜诱导稳定的跨膜孔,但CPPs形成的孔非常不稳定,这与原子模拟结果一致。