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Information card for entry 7156605
Preview
Coordinates | 7156605.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C11.5 H10.5 N1.5 O |
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Calculated formula | C11.5 H10.5 N1.5 O |
Title of publication | Functional characterization of the halogenase SpmH and discovery of new deschloro-tryptophan dimers. |
Authors of publication | Liu, Zhiwen; Ma, Liang; Zhang, Liping; Zhang, Wenjun; Zhu, Yiguang; Chen, Yuchan; Zhang, Weimin; Zhang, Changsheng |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 5 |
Pages of publication | 1053 - 1057 |
a | 10.5966 ± 0.0001 Å |
b | 7.8609 ± 0.0001 Å |
c | 11.8783 ± 0.0001 Å |
α | 90° |
β | 114.143 ± 0.001° |
γ | 90° |
Cell volume | 902.899 ± 0.018 Å3 |
Cell temperature | 99.97 ± 0.19 K |
Ambient diffraction temperature | 99.97 ± 0.19 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0295 |
Residual factor for significantly intense reflections | 0.0291 |
Weighted residual factors for significantly intense reflections | 0.0736 |
Weighted residual factors for all reflections included in the refinement | 0.0739 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7156605.html
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Users of the data should acknowledge the original authors of the
structural data.