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. 2018 May 3;33(1):890–904. doi: 10.1080/14756366.2018.1465417

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© 2018 The Author(s). Published by Informa UK Limited, trading as Taylor & Francis Group.

This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

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Figure 9. — The interactions between 30 and Cat K from molecular modelling. (A) The pocket is shown in electrostatics representation. (B) The detailed interactions between 30 and Cat K. The molecular docking is calculated by AutoDock Vina. Green line: Sidechain hydrogen bond; Blue line: Backbone hydrogen bond; Black line: Covalent bond.