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通过质子核磁共振对环状部分修饰的反向脑啡肽类似物进行构象分析。

Conformational analysis of cyclic partially modified retro-inverso enkephalin analogues by proton NMR.

作者信息

Mammi N J, Goodman M

出版信息

Biochemistry. 1986 Nov 18;25(23):7607-14. doi: 10.1021/bi00371a051.

DOI:10.1021/bi00371a051
PMID:3801437
Abstract

The conformations of five cyclic retro-inverso enkephalin analogues have been probed by proton NMR. After assignment of peaks, intramolecularly hydrogen-bonded amide protons were detected by temperature perturbation. Carbonyl hydrogen-bond acceptors were surmised from the computer simulations of minimum energy conformations of Hassan and Goodman [Hassan, M., & Goodman, M. (1986) Biochemistry (preceding paper in this issue)]. Hydrogen bonds were identified in dimethyl-d6 sulfoxide solutions and monitored as H2O was added. One hydrogen bond was observed in each of the retro-inverso-modified enkephalin analogues although in the parent analogue H-Tyr-c-(D-A2bu-Gly-Phe-Leu) two were detected. The change in solvent altered the conformations of two of the analogues.

摘要

通过质子核磁共振对五种环化反向脑啡肽类似物的构象进行了探究。在对峰进行归属后,通过温度扰动检测到分子内氢键结合的酰胺质子。根据哈桑和古德曼[哈桑,M.,&古德曼,M.(1986年)《生物化学》(本期前一篇论文)]最低能量构象的计算机模拟推测出羰基氢键受体。在二甲基-d6亚砜溶液中鉴定出氢键,并在加入水时进行监测。在每种反向脑啡肽类似物中均观察到一个氢键,尽管在母体类似物H-Tyr-c-(D-A2bu-Gly-Phe-Leu)中检测到两个氢键。溶剂的变化改变了其中两种类似物的构象。

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