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. Author manuscript; available in PMC: 2020 May 7.
Published in final edited form as: Structure. 2019 Mar 1;27(5):749–763.e4. doi: 10.1016/j.str.2019.01.017

Table 1. Calculation of binding energies and buried surface area.

Interface statistics between of BMC-TD2 (two different states) and BMC-TS1 interaction with the surrounding hexamers in the main shell population, calculated using PISA (Krissinel and Henrick, 2007).

ΔGint
(kcal/mol)
Buried area
2)
BMC-TD2 (closed) −17.5 6044
BMC-TD2 (intermediate] −18.2 6682
BMC-TS1 −33.3 7198