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Addition of the respiratory chain inhibitor 2-heptyl-4-hydroxyquinoline n-oxide (HQNO) in concentrations higher than 80 M to membrane fractions abolished O 2 consumption and DCPIP activity, again confirming coupling of LhgO to the respiratory chain (Fig

Footnotes Mirza Hasanuzzaman and Kamrun Nahar have contributed equally to this work

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Harmonic restraints of 50.0 kcal mol 1 2 were applied to the solutes, including the crystallographic ions, to allow solvent relaxation while preserving the maximum fidelity to the docking pose, and the Andersen temperature coupling scheme 81,82 was used to control and equalize the temperature