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. 2007 Dec 12;104(51):20280–20284. doi: 10.1073/pnas.0704599105

Fig. 4.

Fig. 4.

Comparison of the energetic separation and the relative orientation of the transition–dipole moments of the k = 1 and k = 2 exciton states from individual RC–LH1 complexes with results from numerical simulations for three different arrangements of the BChl a molecules in the pigment-protein complex. (Top) The model structures A–C that have been used for the numerical simulations. Details are given in the text. Also shown are the model structures B and C on an exaggerated scale to visualize the differences in the pigment arrangement between the two models more clearly. (Middle) Comparison of the experimentally obtained energetic separations between the k = 1 and k = 2 exciton states (gray columns) with numerical simulations (black squares) for the three model structures. (Bottom) Comparison of the experimentally obtained relative orientations of the transition–dipole of the k = 1 and k = 2 exciton states (gray columns) with numerical simulations (black squares) for the three model structures.