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Information card for entry 2219093
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Coordinates | 2219093.cif |
---|---|
Structure factors | 2219093.hkl |
Original IUCr paper | HTML |
Common name | 6-azido-L-fucose monohydrate |
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Chemical name | 6-Azido-6-deoxy-α-L-galactose monohydrate |
Formula | C6 H13 N3 O6 |
Calculated formula | C6 H13 N3 O6 |
SMILES | O[C@H]1[C@@H](O)[C@H](O)[C@H](O)O[C@H]1CN=N#N.O |
Title of publication | 6-Azido-6-deoxy-α-<small>L</small>-galactose (6-azido-<small>L</small>-fucose) monohydrate |
Authors of publication | Booth, K. Victoria; Jenkinson, Sarah F.; Rao, Devendar; Simonisi, Tsuyosi; Fleet, George W. J.; Izumori, Ken; Watkin, David J. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2008 |
Journal volume | 64 |
Journal issue | 8 |
Pages of publication | o1568 - o1569 |
a | 5.9687 ± 0.0003 Å |
b | 7.7395 ± 0.0004 Å |
c | 20.9768 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 969.02 ± 0.09 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.0551 |
Residual factor for significantly intense reflections | 0.0331 |
Weighted residual factors for all reflections | 0.0726 |
Weighted residual factors for significantly intense reflections | 0.0675 |
Weighted residual factors for all reflections included in the refinement | 0.0726 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.8037 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2219093.html
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Users of the data should acknowledge the original authors of the
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