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Nucleotide-dependent conformations of the flexible loop in YchF. Shown are histograms of the Cα–Cα (His-114 to Ser-16) distances (bin size of 0.4 Å) measured during 50-ns MD simulations of the YchF·ATP·Mg2+, YchF·ADP·Mg2+, and apo-YchF models.
