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Differential multiple-quantum relaxation arising from cross-correlated time-modulation of isotropic chemical shifts

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Abstract

In this paper it is demonstrated that cross-correlated time modulation of isotropic chemical shifts (`conformational exchange') leads to differential relaxation of double- and zero-quantum coherences, respectively. Quantitative information can be obtained from the time dependence of the interconversion between the two two-spin coherences 2IxSx and 2IySy, induced by the differential relaxation. The effect is illustrated with an application to 13C,15N-labeled quail CRP2(LIM2), by studying 15N-1HN multiple-quantum relaxation. Significant cross-correlated fluctuations of isotropic chemical shifts were observed for residues which are part of a disordered loop region connecting two β-strands in CRP2(LIM2). Differential 1HN and 15N exchange contributions to multiple-quantum relaxation observed at these sites illustrate the complex interplay between hydrogen bonding events and conformational reorientations in proteins.

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Authors and Affiliations

  1. Institute of Organic Chemistry, University of Innsbruck, Innrain 52a, A6020 , Innsbruck, Austria

    Karin Kloiber & Robert Konrat

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  1. Karin Kloiber
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  2. Robert Konrat
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Kloiber, K., Konrat, R. Differential multiple-quantum relaxation arising from cross-correlated time-modulation of isotropic chemical shifts. J Biomol NMR 18, 33–42 (2000). https://doi.org/10.1023/A:1008317212558

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