首页> 外文期刊>The journal of physical chemistry, B. Condensed matter, materials, surfaces, interfaces & biophysical >Exciton Simulations of Optical Spectra of the FMO Complex from the Green Sulfur Bacterium Chlorobium tepidum at 6 K
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Exciton Simulations of Optical Spectra of the FMO Complex from the Green Sulfur Bacterium Chlorobium tepidum at 6 K

机译:在6 K下从绿色硫细菌绿藻细菌FMO络合物的激子模拟

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摘要

Optical spectra (absorption, circular dichroism, linear dichroism, and triplet-minus-singlet), measured at 6 K, are presented for the Fenna-Matthews-Olson (FMO) complex from the green sulfur bacterium Chlorobium (C.) tepidum. Significant differences are observed in comparison with the corresponding spectra of Prosthecochloris (P.) aestuarii. The spectra of C. tepidum FMO were simulated using exciton calculations, based on the recently resolved structure of this complex [Li et al. J. Mol. Biol. 1997, 271 456]. These calculations apply the same basic assumptions as were earlier used for the FMO complex from P. aestuarii [Louwe et al. J. Phys. Chem. B 1997, 101, 11280], except that the site energies of all but one of the bacteriochlorophylls had to be changed in order to optimize the simulations. The good agreement that was obtained supports the assumptions in these model calculations, and the assignment of the site energies makes it possible to consider the spectra in relation to the structural differences between the two types of FMO complex.
机译:呈现了在6 K下测量的绿色硫磺细菌绿皮细菌(C.)pidpidum的Fenna-Matthews-Olson(FMO)复合物的光谱(吸收,圆二色性,线性二色性和三重态-负单重态)。与相应的Prosthecochloris(P.)aestuarii光谱相比,观察到了显着差异。基于该复合体最近解析的结构,使用激子计算模拟了纤毛梭菌FMO的光谱[Li等人。 J.摩尔生物学1997,271 456]。这些计算所采用的基本假设与早先用于P. aestuarii的FMO复合物的方法相同[Louwe等。 J.物理化学B 1997,101,11280],只是必须改变除一种叶绿素以外的所有位点能量,以优化模拟。所获得的良好一致性支持了这些模型计算中的假设,并且现场能量的分配使得可以考虑与两种类型的FMO复合物之间的结构差异有关的光谱。

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