Department of Molecular Medicine, Cornell University, Ithaca, NY 14853, USA.
Department of Molecular Medicine, Cornell University, Ithaca, NY 14853, USA.
J Struct Biol. 2020 Sep 1;211(3):107572. doi: 10.1016/j.jsb.2020.107572. Epub 2020 Jul 8.
McrBC is a conserved modification-dependent restriction system that in Escherichia coli specifically targets foreign DNA containing methylated cytosines. Crystallographic data show that the N-terminal domain of Escherichia coli McrB binds substrates via a base flipping mechanism. This region is poorly conserved among the plethora of McrB homologs, suggesting that other species may use alternative binding strategies and/or recognize different targets. Here we present the crystal structure of the N-terminal domain from Stayphlothermus marinus McrB (Sm3-180) at 1.92 Å, which adopts a PUA-like EVE fold that is closely related to the YTH and ASCH RNA binding domains. Unlike most PUA-like domains, Sm3-180 binds DNA and can associate with different modified substrates. We find the canonical 'aromatic cage' binding pocket that confers specificity for methylated bases in other EVE/YTH domains is degenerate and occluded in Sm3-180, which may contribute to its promiscuity in target recognition. Further structural comparison between different PUA-like domains identifies motifs and conformational variations that correlate with the preference for binding either DNA or RNA. Together these data have important implications for PUA-like domain specificity and suggest a broader biological versatility for the McrBC family than previously described.
McrBC 是一种保守的依赖修饰的限制系统,可特异性靶向含有甲基化胞嘧啶的外源 DNA。晶体学数据表明,大肠杆菌 McrB 的 N 端结构域通过碱基翻转机制结合底物。该区域在大量 McrB 同源物中保守性较差,这表明其他物种可能使用替代的结合策略和/或识别不同的靶标。在这里,我们展示了来自嗜热栖热菌(Stayphlothermus marinus)McrB(Sm3-180)的 N 端结构域的晶体结构,分辨率为 1.92Å,采用了与 YTH 和 ASCH RNA 结合结构域密切相关的 PUA 样 EVE 折叠。与大多数 PUA 样结构域不同,Sm3-180 可以结合 DNA 并与不同的修饰底物结合。我们发现了赋予其他 EVE/YTH 结构域中甲基化碱基特异性的典型“芳香笼”结合口袋在 Sm3-180 中是退化和被阻塞的,这可能有助于其在靶标识别中的混杂性。对不同 PUA 样结构域的进一步结构比较确定了与 DNA 或 RNA 结合偏好相关的基序和构象变化。这些数据对 PUA 样结构域的特异性有重要影响,并表明 McrBC 家族的生物学多功能性比以前描述的更广泛。