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Figure 3
The conformational differences visualized by superpositions of molecules: (a) KEMRUP and β-ket, (b) β-ket and α-ket molecule A, and (c) β-ket and α-ket molecule B. RMSD values [calculated in Mercury (version 3.8; Macrae et al., 2006BB34)] are equal to (a) 0.0795, (b) 0.7174 and (c) 1.1643 Å.

Volume 5| Part 6| November 2018| Pages 841-853
ISSN: 2052-2525