Two and Three Dimensional Nuclear Quadrupole Resonance in the Investigation of Structure and Bonding

Author:

Liao Ming-Yuan1,Subramanian Raju2,Yung Rachel L.3,Harbison Gerard S.3

Affiliation:

1. 1Current address: Department of Applied Chemistry, National Chi Nan University, Puli, Taiwan, Republic of China

2. 2Current address: Beckman Institute for Advanced Science and Technology, University of Illinois at Urbana-Champaign, Urbana, IL 61801, USA

3. 3Department of Chemistry, Hamilton Hall, 508, University of Nebraska at Lincoln, Lincoln, NE 68588-0304, USA

Abstract

A variety of two dimensional two-and three-dimensional NQR experiments are reviewed, showing their application to the determination of field gradients for important sites in peptides and proteins, for assigning connected transitions of nuclei with spin ≥ 5/2, and for determining hexadecapolar coupling constants. The quadrupole coupling tensor for 63Cu in the active site of a protein, bovine erythrocyte (Cu, Zn) superoxide dismutase, has been measured and is compared with the results of ab initio calculations.

Publisher

Walter de Gruyter GmbH

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy,Mathematical Physics

Cited by 10 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献

1. Low Temperature 65Cu NMR Spectroscopy of the Cu+ Site in Azurin;Journal of the American Chemical Society;2009-09-11

2. Solid state NMR: new tools for insight into enzyme function;Current Opinion in Structural Biology;2007-10

3. Applications of nuclear quadrupole resonance spectroscopy in drug development;Expert Opinion on Drug Discovery;2007-02

4. Operator formalisms: An overview;Concepts in Magnetic Resonance Part A;2006

5. Exact calculation, using angular momentum, of combined Zeeman and quadrupolar interactions in NMR;Molecular Physics;2003-11-10

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