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. 2014 Mar 27;9(3):e93267. doi: 10.1371/journal.pone.0093267

Figure 4. Structures of PIIIA in complex with NaV1.4 predicted from MD simulations biased with distance restraints.

Figure 4

In two binding modes of PIIIA-NaV1.4, Lys9 (A and B) and Arg14 (C and D) of the toxin protrudes into the filter of the channel, respectively. In (A) and (C), the Na+ ion inside the filter is shown as a yellow sphere. Toxin backbone is in yellow and channel backbone in grey.