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. Author manuscript; available in PMC: 2020 Feb 11.
Published in final edited form as: J Chem Inf Model. 2019 Sep 9;59(9):4007–4017. doi: 10.1021/acs.jcim.9b00605

Figure 7.

Figure 7.

Stabilizing interactions formed during the etoposide unbinding, with (A) Met762α; (B) Ser763α; (C) and (D) Ser800α in the TopoIIα and with (E) Gln778β in the TopoIIβ isoform, mutated to Met762 in TopoIIα.