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Information card for entry 1557922
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Coordinates | 1557922.cif |
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Original paper (by DOI) | HTML |
Formula | C72 H88 N12 O16 |
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Calculated formula | C72 H88.0031 N12 O16 |
Title of publication | Production of Antitubercular Depsipeptides via Biosynthetic Engineering of Cinnamoyl Units |
Authors of publication | Yang, Zhijie; Sun, Changli; Liu, Zhiyong; Liu, Qing; Zhang, Tianyu; Ju, Jianhua; Ma, Junying |
Journal of publication | Journal of Natural Products |
Year of publication | 2020 |
a | 12.5668 ± 0.0002 Å |
b | 20.9262 ± 0.0003 Å |
c | 15.2207 ± 0.0002 Å |
α | 90° |
β | 103.722 ± 0.002° |
γ | 90° |
Cell volume | 3888.43 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0526 |
Residual factor for significantly intense reflections | 0.0452 |
Weighted residual factors for significantly intense reflections | 0.1209 |
Weighted residual factors for all reflections included in the refinement | 0.1262 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
251192 (current) | 2020-04-27 | cif/ Adding structures of 1557922 via cif-deposit CGI script. |
1557922.cif |
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Users of the data should acknowledge the original authors of the
structural data.