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Information card for entry 7129917
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Coordinates | 7129917.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Perguanidino-gamma-Cyclodextrin |
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Chemical name | Perguanidino-gamma-Cyclodextrin |
Formula | C112 H249.64 N50 O112.32 P9 |
Calculated formula | C112 H203 N49 O94.72 P4.6 |
Title of publication | A guanidino-γ-cyclodextrin superdimer generates a twin receptor for phosphate dimers assembled by anti-electrostatic hydrogen bonds |
Authors of publication | Saridakis, Emmanuel; Kasimati, Eleni Marina; Yannakopoulou, Konstantina; Mavridis, Irene M. |
Journal of publication | Chemical Communications |
Year of publication | 2022 |
a | 26.9 ± 0.02 Å |
b | 36.4 ± 0.02 Å |
c | 53.2 ± 0.02 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 52091 ± 5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 20 |
Hermann-Mauguin space group symbol | C 2 2 21 |
Hall space group symbol | C 2c 2 |
Residual factor for all reflections | 0.1397 |
Residual factor for significantly intense reflections | 0.129 |
Weighted residual factors for significantly intense reflections | 0.3187 |
Weighted residual factors for all reflections included in the refinement | 0.3299 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.386 |
Diffraction radiation wavelength | 0.912 Å |
Diffraction radiation type | SYNCHROTRON |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7129917.html
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