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. 2019 Oct 28;4(20):18889–18899. doi: 10.1021/acsomega.9b02949

Figure 8.

Figure 8

Relation between the dynamic behavior of the binding pocket and the stability of the lipid binding over time shown for a representative simulation of cinnamycin with (a) POPE bound with the HyAsp15 side chain restrained (PE_HyAsp_HyAsp+), (b) POmPE bound (mPE_HyAsp), (c) POmPE bound with HyAsp15 side chain restrained (mPE_HyAsp_HyAsp+), (d) POPS bound (PS_HyAsp), and (e) POPC bound (PC_HyAsp). Color coding and axes are the same as in Figure 6.