血红蛋白R→T跃迁过程中索共振拉曼强度的瞬态变化建模

Laser Chemistry Pub Date : 1900-01-01 DOI:10.1155/1999/70916
T. Rush, R. Kumble, T. Spiro
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引用次数: 0

摘要

我们对Ni和Zn卟啉的soret -谐振拉曼光谱进行了共振拉曼(RR)强度计算,以研究血红蛋白在时间分辨soret -谐振拉曼(RR)光谱中观察到的核心尺寸强度差异。结果表明,金属卟啉强度主要来源于Cα-Cm键和Cβ-Cβ键在激发态下的扩张,二者之间的差异主要是由于核尺寸较大的血红素具有较小的Cα-Cm力常数,激发态卟啉环的扩张较大。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Modeling the Transient Changesin the Soret-Resonant RamanIntensities of Hemoglobin DuringThe R→ T Transition
We have performed resonance Raman (RR) intensity calculations of the Soret-resonant Raman spectra of Ni and Zn Porphine to investigate observed core size intensity differences in the time-resolved Soret-resonant Raman (RR) spectra of hemoglobin. It was found that the metalloporphine intensities mainly derive from the expansion of the Cα—Cm and Cβ—Cβ bonds in the excited state, and that the observed differences are mainly due to the larger core-sized heme having a decreased Cα—Cm force constant and larger excited state porphyrin ring expansion.
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