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相关概念视频

¹H NMR of Conformationally Flexible Molecules: Temporal Resolution00:52

¹H NMR of Conformationally Flexible Molecules: Temporal Resolution

855
At room temperature, the chair conformer of cyclohexane undergoes rapid ring flipping between two equivalent chair conformers at a rate of approximately 105 times per second. These two chair conformers are in equilibrium. The rapid ring flipping results in the interconversion of the axial proton to an equatorial proton and an equatorial to the axial proton. Such interconversions are too rapid and cannot be detected on the NMR timescale. Hence, the NMR spectrometer cannot distinguish between the...
855
NMR Spectroscopy: Spin–Spin Coupling01:08

NMR Spectroscopy: Spin–Spin Coupling

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The spin state of an NMR-active nucleus can have a slight effect on its immediate electronic environment. This effect propagates through the intervening bonds and affects the electronic environments of NMR-active nuclei up to three bonds away; occasionally, even farther. This phenomenon is called spin–spin coupling or J-coupling. Coupling interactions are mutual and result in small changes in the absorption frequencies of both nuclei involved. While nuclei of the same element are involved...
1.4K
¹H NMR: Complex Splitting01:13

¹H NMR: Complex Splitting

1.3K
A proton M that is coupled to a proton X results in doublet signals for M. However, NMR-active nuclei can be simultaneously coupled to more than one nonequivalent nucleus. When M is coupled to a second proton A, such as in styrene oxide, each peak in the doublet is split into another doublet.
Splitting diagrams or splitting tree diagrams are routinely used to depict such complex couplings. While drawing splitting diagrams, the splitting with the larger coupling constant is usually applied...
1.3K
Double Resonance Techniques: Overview01:12

Double Resonance Techniques: Overview

218
Double resonance techniques in Nuclear Magnetic Resonance (NMR) spectroscopy involve the simultaneous application of two different frequencies or radiofrequency pulses to manipulate and observe two distinct nuclear spins. One important application of double resonance is spin decoupling, which selectively suppresses coupling with one type of nucleus while observing the NMR signal from another nucleus, simplifying the spectrum and enhancing resolution.
Spin decoupling is usually achieved by...
218
NMR and Mass Spectroscopy of Carboxylic Acids01:30

NMR and Mass Spectroscopy of Carboxylic Acids

4.0K
In ¹H NMR spectroscopy, acidic protons (–COOH) of carboxylic acids are highly deshielded and absorb far downfield, at around 9–12 ppm. The chemical shift value depends on the concentration and solvent used.
While α protons of carboxylic acids absorb at 2–2.5 ppm, β protons absorb further upfield.
Carboxylic acids are easily identified by dissolving them in deuterium oxide, which results in a rapid exchange of the acidic protons with deuterium. This leads to the...
4.0K
2D NMR: Overview of Homonuclear Correlation Techniques01:16

2D NMR: Overview of Homonuclear Correlation Techniques

209
Homonuclear correlation spectroscopy (COSY) is a powerful technique used in Nuclear Magnetic Resonance (NMR) spectroscopy to study the correlations between nuclei of the same type within a molecule. It provides information about scalar couplings between adjacent nuclei, which helps determine connectivity and structural information. There are several COSY variants, each with its unique strengths and experimental parameters.
COSY90 is the standard two-dimensional (2D) COSY experiment that...
209

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相关实验视频

Updated: Jul 11, 2025

Atomic Scale Structural Studies of Macromolecular Assemblies by Solid-state Nuclear Magnetic Resonance Spectroscopy
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5D固态NMR光谱用于促进共振分配.

Alexander Klein1, Suresh K Vasa1, Rasmus Linser2

  • 1Department of Chemistry and Chemical Biology, TU Dortmund University, Otto-Hahn-Str. 4a, 44227, Dortmund, Germany.

Journal of biomolecular NMR
|November 9, 2023
PubMed
概括

五维 (5D) 固态NMR光谱简化了蛋白质共振分配. 这种技术提高了大型和小型蛋白质目标的效率和准确性,克服了传统方法的局限性.

关键词:
5D 5D是什么意思? 5D是什么意思?快速的魔法角度旋转旋转更高的维度,更高的维度.最少的一组实验实验.不统一的抽样采集方式质子检测检测的质子检测.响应赋值的共振分配固态NMR是一种固态NMR.

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科学领域:

  • 结构生物学 结构生物学
  • 生物物理化学 生物物理化学
  • 核磁共振 (NMR) 光谱学 核磁共振 (NMR) 光谱学

背景情况:

  • 固态NMR光谱对于蛋白质的表征至关重要.
  • 高维度NMR有助于在大型蛋白质中的共振赋值.
  • 响应分配是固态NMR中的时间限制瓶.

研究的目的:

  • 为了证明5D固态NMR可简化蛋白质中的共振分配.
  • 为了证明5DNMR对中小型蛋白质点的适用性.
  • 展示5D NMR作为传统赋值方法的实用和有效替代方案.

主要方法:

  • 使用了5D固态NMR光谱学.
  • 采用了不统一的采样和光谱重建算法.
  • 应用于化和质子反交换的微晶蛋白质,以快速的魔法角旋转.

主要成果:

  • 在高灵敏度的5D中实现了直接的胺对胺相关性.
  • 经过证明的高效和高可靠的骨干路径用于分配.
  • 集成的侧链与骨干相关性,用于同时分配.

结论:

  • 5D固态NMR对高分子量和较小的蛋白质有效.
  • 这种方法为3D分配策略提供了一个有力的替代方案,减少了模两可.
  • 这种方法促进了自动化,并扩大了对基于NMR的蛋白质表征的访问.