Crystallography Open Database

Information card for entry 7124665

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Coordinates	7124665.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H80 N16 O12
Calculated formula	C68 H80 N16 O12
Title of publication	Tetrameric psuedo-peptide receptors with allosteric properties.
Authors of publication	Chung, Mee-Kyung; Lee, Stephen J.; Waters, Marcey L.; Gagné, Michel R
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	52
Pages of publication	8103 - 8106
a	22.2194 ± 0.0006 Å
b	26.8073 ± 0.0008 Å
c	30.7909 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	18340.4 ± 0.9 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0995
Residual factor for significantly intense reflections	0.0743
Weighted residual factors for significantly intense reflections	0.1892
Weighted residual factors for all reflections included in the refinement	0.2046
Goodness-of-fit parameter for all reflections included in the refinement	0.945
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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