Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2022851
Preview
| Coordinates | 2022851.cif |
|---|---|
| Structure factors | 2022851.hkl |
| Original IUCr paper | HTML |
| Chemical name | 2'-Deoxyguanosine dimethyl sulfoxide disolvate |
|---|---|
| Formula | C14 H25 N5 O6 S2 |
| Calculated formula | C14 H25 N5 O6 S2 |
| Title of publication | Crystal structure of the nucleoside 2′-deoxyguanosine dimethyl sulfoxide disolvate |
| Authors of publication | Spingler, Bernhard |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | 9 |
| Pages of publication | 852 - 855 |
| a | 9.759 ± 0.0001 Å |
| b | 11.7951 ± 0.0002 Å |
| c | 16.7553 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1928.68 ± 0.04 Å3 |
| Cell temperature | 183.15 K |
| Ambient diffraction temperature | 183.15 K |
| Number of distinct elements | 5 |
| 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 | 0.0355 |
| Residual factor for significantly intense reflections | 0.0304 |
| Weighted residual factors for significantly intense reflections | 0.0717 |
| Weighted residual factors for all reflections included in the refinement | 0.0729 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 285926 (current) | 2023-08-31 | cif/ hkl/ Adding structures of 2022851 via cif-deposit CGI script. |
2022851.cif 2022851.hkl |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.