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Information card for entry 1563747
Preview
Coordinates | 1563747.cif |
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Original paper (by DOI) | HTML |
Formula | C61 H76 N4 O10 |
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Calculated formula | C61 H76 N4 O10 |
Title of publication | [11]-Chaetoglobosins from Pseudeurotium bakeri Induce G2/M Cell Cycle Arrest and Apoptosis in Human Cancer Cells |
Authors of publication | Duan, Fang-Fang; Liu, Lin; Gao, Ying; Peng, Xiao-Gang; Meng, Xiang-Gao; Ruan, Han-Li |
Journal of publication | Journal of Natural Products |
Year of publication | 2021 |
a | 16.8156 ± 0.0002 Å |
b | 9.9046 ± 0.0001 Å |
c | 17.1204 ± 0.0002 Å |
α | 90° |
β | 98.632 ± 0.001° |
γ | 90° |
Cell volume | 2819.13 ± 0.06 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 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 | 0.0518 |
Residual factor for significantly intense reflections | 0.0467 |
Weighted residual factors for significantly intense reflections | 0.1267 |
Weighted residual factors for all reflections included in the refinement | 0.1309 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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266752 (current) | 2021-06-29 | cif/ Adding structures of 1563747 via cif-deposit CGI script. |
1563747.cif |
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structural data.