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具有多个接收器的核磁共振

NMR with multiple receivers.

作者信息

Kupče Eriks

机构信息

Agilent Technologies, NMR and MRI Systems, Yarnton, Oxford, OX5 1QU, UK,

出版信息

Top Curr Chem. 2013;335:71-96. doi: 10.1007/128_2011_226.

DOI:10.1007/128_2011_226
PMID:21837554
Abstract

Parallel acquisition NMR spectroscopy (PANSY) is used to detect simultaneously signals from up to four nuclear species, such as H-1, H-2, C-13, N-15, F-19 and P-31. The conventional COSY, TOCSY, HSQC, HMQC and HMBC pulse sequences have been adapted for such applications. Routine availability of NMR systems that incorporate multiple receivers has led to development of new types of NMR experiments. One such scheme named PANACEA allows unambiguous structure determination of small organic molecules from a single measurement and includes an internal field/frequency correction routine. It does not require the conventional NMR lock system and can be recorded in pure liquids. Furthermore, long-range spin-spin couplings can be extracted from the PANACEA spectra and used for three-dimensional structure refinement. In bio-molecular NMR, multi-receiver NMR systems are used for simultaneous recording of H-1 and C-13 detected multi-dimensional spectra. For instance, the 2D (HA)CACO and 3D (HA)CA(CO)NNH experiments can be recorded simultaneously in proteins of moderate size (up to 30 kDa). The multi-receiver experiments can also be used in combination with the fast acquisition schemes such as Hadamard spectroscopy, computer optimized aliasing and projection-reconstruction techniques. In general, experiments that utilize multiple receivers provide significantly more information from a single NMR measurement as compared to the conventional single receiver techniques.

摘要

并行采集核磁共振波谱法(PANSY)用于同时检测多达四种核素的信号,如H-1、H-2、C-13、N-15、F-19和P-31。传统的COSY、TOCSY、HSQC、HMQC和HMBC脉冲序列已适用于此类应用。配备多个接收器的核磁共振系统的常规可用性推动了新型核磁共振实验的发展。一种名为PANACEA的方案能够通过单次测量明确确定小分子的结构,并且包括一个内部场/频率校正程序。它不需要传统的核磁共振锁定系统,并且可以在纯液体中记录。此外,长程自旋-自旋耦合可以从PANACEA谱中提取出来,并用于三维结构优化。在生物分子核磁共振中,多接收器核磁共振系统用于同时记录检测到的H-1和C-13多维谱。例如,二维(HA)CACO和三维(HA)CA(CO)NNH实验可以在中等大小(高达30 kDa)的蛋白质中同时记录。多接收器实验也可以与快速采集方案结合使用,如哈达玛光谱法、计算机优化混叠和投影重建技术。一般来说,与传统的单接收器技术相比,利用多个接收器的实验从单次核磁共振测量中提供的信息要多得多。

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