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通过X射线晶体学显示的钌配合物Λ-[Ru(TAP)(dppz)]与形成G-四链体的序列d(TAGGGTT)的三种胸腺嘧啶/腺嘌呤结合模式。

Three thymine/adenine binding modes of the ruthenium complex Λ-[Ru(TAP)(dppz)] to the G-quadruplex forming sequence d(TAGGGTT) shown by X-ray crystallography.

作者信息

McQuaid Kane, Hall James P, Baumgaertner Lena, Cardin David J, Cardin Christine J

机构信息

Department of Chemistry, University of Reading, Whiteknights, Reading, RG6 6AD, UK.

出版信息

Chem Commun (Camb). 2019 Jul 30;55(62):9116-9119. doi: 10.1039/c9cc04316k.

Abstract

Λ-[Ru(TAP)2(dppz)]2+ was crystallised with the G-quadruplex-forming heptamer d(TAGGGTT). Surprisingly, even though there are four unique binding sites, the complex is not in contact with any G-quartet surface. Two complexes stabilise cavities formed from terminal T·A and T·T mismatched pairs. A third shows kinking by a TAP ligand between T·T linkages, while the fourth shows sandwiching of a dppz ligand between a T·A/T·A quadruplex and a T·T mismatch, stabilised by an additional T·A base pair stacking interaction on a TAP surface. Overall, the structure shows an unexpected affinity for thymine, and suggests models for G-quadruplex loop binding.

摘要

Λ-[Ru(TAP)₂(dppz)]²⁺与形成G-四链体的七聚体d(TAGGGTT)一起结晶。令人惊讶的是,尽管有四个独特的结合位点,但该配合物并未与任何G-四重体表面接触。两个配合物稳定了由末端T·A和T·T错配形成的空腔。第三个显示TAP配体在T·T连接之间产生扭结,而第四个显示dppz配体夹在T·A/T·A四链体和T·T错配之间,并通过TAP表面上额外的T·A碱基对堆积相互作用得以稳定。总体而言,该结构显示出对胸腺嘧啶出乎意料的亲和力,并提出了G-四链体环结合的模型。

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