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Information card for entry 4132498
Preview
| Coordinates | 4132498.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C174 H202 I6 N33 O31 Zn3 |
|---|---|
| Calculated formula | C174 H201 I6 N33 O31 Zn3 |
| Title of publication | Synthetic β-Barrel by Metal-Induced Folding and Assembly. |
| Authors of publication | Yamagami, Motoya; Sawada, Tomohisa; Fujita, Makoto |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 28 |
| Pages of publication | 8644 - 8647 |
| a | 28.4415 ± 0.0003 Å |
| b | 28.4415 ± 0.0003 Å |
| c | 85.872 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 69463.5 ± 1.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.257 |
| Residual factor for significantly intense reflections | 0.1957 |
| Weighted residual factors for significantly intense reflections | 0.4512 |
| Weighted residual factors for all reflections included in the refinement | 0.4922 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.564 |
| Diffraction radiation wavelength | 1 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242471 (current) | 2019-11-26 | cif/ Adding structures of 4132498 via cif-deposit CGI script. |
4132498.cif |
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