Lee Donghan, Walsh Joseph D, Yu Ping, Markus Michelle A, Choli-Papadopoulou Theodora, Schwieters Charles D, Krueger Susan, Draper David E, Wang Yun-Xing
Protein Nucleic Acid Interaction Section, Structural Biophysics Laboratory, NCI-Frederick, NIH, Frederick, MD 21702, USA.
J Mol Biol. 2007 Apr 6;367(4):1007-22. doi: 10.1016/j.jmb.2007.01.013. Epub 2007 Jan 10.
The L11 binding site is one of the most important functional sites in the ribosome. The N-terminal domain of L11 has been implicated as a "reversible switch" in facilitating the coordinated movements associated with EF-G-driven GTP hydrolysis. The reversible switch mechanism has been hypothesized to require conformational flexibility involving re-orientation and re-positioning of the two L11 domains, and warrants a close examination of the structure and dynamics of L11. Here we report the solution structure of free L11, and relaxation studies of free L11, L11 complexed to its 58 nt RNA recognition site, and L11 in a ternary complex with the RNA and thiostrepton antibiotic. The binding site of thiostrepton on L11 was also defined by analysis of structural and dynamics data and chemical shift mapping. The conclusions of this work are as follows: first, the binding of L11 to RNA leads to sizable conformation changes in the regions flanking the linker and in the hinge area that links a beta-sheet and a 3(10)-helix-turn-helix element in the N terminus. Concurrently, the change in the relative orientation may lead to re-positioning of the N terminus, as implied by a decrease of radius of gyration from 18.5 A to 16.2 A. Second, the regions, which undergo large conformation changes, exhibit motions on milliseconds-microseconds or nanoseconds-picoseconds time scales. Third, binding of thiostrepton results in more rigid conformations near the linker (Thr71) and near its putative binding site (Leu12). Lastly, conformational changes in the putative thiostrepton binding site are implicated by the re-emergence of cross-correlation peaks in the spectrum of the ternary complex, which were missing in that of the binary complex. Our combined analysis of both the chemical shift perturbation and dynamics data clearly indicates that thiostrepton binds to a pocket involving residues in the 3(10)-helix in L11.
L11结合位点是核糖体中最重要的功能位点之一。L11的N端结构域被认为是一个“可逆开关”,有助于与EF-G驱动的GTP水解相关的协同运动。据推测,可逆开关机制需要构象灵活性,涉及两个L11结构域的重新定向和重新定位,因此有必要对L11的结构和动力学进行仔细研究。在此,我们报告了游离L11的溶液结构,以及游离L11、与58 nt RNA识别位点复合的L11以及与RNA和硫链丝菌素抗生素形成的三元复合物中L11的弛豫研究。通过对结构和动力学数据以及化学位移图谱的分析,还确定了硫链丝菌素在L11上的结合位点。这项工作的结论如下:第一,L11与RNA的结合导致连接区两侧以及连接N端β折叠和3(10)-螺旋-转角-螺旋元件的铰链区发生相当大的构象变化。同时,相对取向的变化可能导致N端重新定位,回转半径从18.5 Å减小到16.2 Å就暗示了这一点。第二,发生大构象变化的区域在毫秒-微秒或纳秒-皮秒时间尺度上表现出运动。第三,硫链丝菌素的结合导致连接区(Thr71)附近和其假定结合位点(Leu12)附近的构象更加刚性。最后,三元复合物光谱中重新出现了二元复合物光谱中缺失的交叉相关峰,这暗示了假定的硫链丝菌素结合位点的构象变化。我们对化学位移扰动和动力学数据的综合分析清楚地表明,硫链丝菌素结合到一个涉及L11中3(10)-螺旋中残基的口袋中。