Evaluation of Cross-Peak Volumes in 2D-Spectra Using 1D-Fitting of Line Shapes

被引:5
作者
Barsukov, I. L. [1 ]
Pervushin, K. V. [1 ]
Orekhov, V. Yu. [1 ]
Barsukov, T. L. [1 ]
Arseniev, A. S. [1 ]
机构
[1] Russian Acad Sci, MM Shemyakin Bioorgan Chem Inst, Moscow 437, Russia
关键词
D O I
10.1007/BF03166166
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
An interactive technique for the evaluation of cross-peak volumes in 2D-spectra is presented, based on a 1D nonlinear curve-fitting procedure. The effects of applied window functions, truncation of time domain data and cross-peak overlap on the evaluated cross-peak volumes are considered. The technique is applied to crowded NOESY spectra of the 34-65 and 163-231 fragments of bacterioopsin of Halobacterium halobium. For these spectra 284 and 546 cross-peak volumes were measured with high accuracy.
引用
收藏
页码:965 / 973
页数:9
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