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. Author manuscript; available in PMC: 2024 Jun 6.
Published in final edited form as: J Am Chem Soc. 2023 Dec 22;146(1):677–694. doi: 10.1021/jacs.3c10406

Table 3.

B- and Z-form populations in the 8mG4 d(CpG)3 constructs at different temperatures determined from peak volume integration.

Residue/Atom identity B-form population (%) at 5°C B-form population (%) at 15°C B-form population (%) at 20°C B-form population (%) at 25°C B-form population (%) at 30°C B-form population (%) at 35°C
Cyt1/C1’ 12.5 14.0 13.3 9.3 3.9 2.9
Gua2/C1’ 17.3 14.8 16.5 10.3 9.4 2.7
Gua2/C8 16.9 10.7 7.9 4.9 1.3 0.51
Gua6/C8 11.1 9.6 8.8 8.8 0.82 0.36
average 14.4 ± 3.1 12.3 ± 2.5 11.6 ± 4.0 8.3 ± 2.3 3.9 ± 3.9 1.6 ± 1.4