Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7711618
Preview
| Coordinates | 7711618.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H27 N3 O6 Zn |
|---|---|
| Calculated formula | C29 H27 N3 O6 Zn |
| Title of publication | The effects of metal cofactors on the reactivity of quercetin 2,4-dioxygenase: synthetic model studies with M(II)-complexes (M = Mn, Co, Ni, Cu, Zn) and assessment of the regulatory factors in catalytic efficacy. |
| Authors of publication | Podder, Nirmalya; Mandal, Sukanta |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2022 |
| a | 14.27 ± 0.05 Å |
| b | 12.9 ± 0.04 Å |
| c | 15.06 ± 0.05 Å |
| α | 90° |
| β | 92.99 ± 0.05° |
| γ | 90° |
| Cell volume | 2769 ± 16 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1243 |
| Residual factor for significantly intense reflections | 0.0567 |
| Weighted residual factors for significantly intense reflections | 0.1224 |
| Weighted residual factors for all reflections included in the refinement | 0.1489 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278887 (current) | 2022-11-01 | cif/ Adding structures of 7711617, 7711618, 7711619, 7711620, 7711621 via cif-deposit CGI script. |
7711618.cif |
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.