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Modeling light-driven proton pumps in artificial photosyntheticreaction centers

机译:在人造光合作用中心中模拟光驱动质子泵

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We study a model of a light-induced proton pump in artificial reaction centers. The model containsa molecular triad with four electron states (i.e., one donor state, two photosensitive group states, andone acceptor state) as well as a molecular shuttle having one electron and one proton-binding sites.The shuttle diffuses between the sides of the membrane and translocates protons energeticallyuphill: from the negative side to the positive side of the membrane, harnessing for this purpose theenergy of the electron-charge separation produced by light. Using the methods of quantum transporttheory we calculate the range of light intensity and transmembrane potentials that maximize both thelight-induced proton current and the energy transduction efficiency. We also study the effect oftemperature on proton pumping. The light-induced proton pump in our model gives a quantum yieldof proton translocation of about 55%. Thus, our results explain previous experiments on theseartificial photosynthetic reaction centers.
机译:我们在人工反应中心研究了一种光诱导质子泵的模型。该模型包含具有三个电子态(即一个供体态,两个感光基团态和一个受体态)的分子三重态,以及一个带有一个电子和一个质子结合位点的分子穿梭分子。该穿梭分子在膜的侧面之间扩散。并使质子从壁的负侧向能量上侧跃迁,为此目的利用了光产生的电子电荷分离的能量。使用量子传输理论的方法,我们计算了光强度和跨膜电势的范围,该范围使光感应质子电流和能量转换效率均最大化。我们还研究了温度对质子泵送的影响。在我们的模型中,光感应质子泵的质子移位量子产率约为55%。因此,我们的结果解释了这些人工光合作用反应中心的先前实验。

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