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. 2016 Oct 13;37(31):2687–2700. doi: 10.1002/jcc.24494

Figure 11.

Figure 11

Experimentally determined complex structures and sampled conformations. The blue‐colored region is the common‐binding region of the experimental structure. Red is the sampled one. The sampled conformations are selected from the vicinity of the bound form in the free‐energy landscape (Fig. 9), and are superimposed on the bound form. White‐colored regions are outside the common‐binding regions. Cyan‐colored regions are partners. [Color figure can be viewed at wileyonlinelibrary.com]