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Information card for entry 2108428
Preview
| Coordinates | 2108428.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C149 N30 O78 S6 |
|---|---|
| Calculated formula | C149 N30 O78 S6 |
| Title of publication | Revisiting the structure of a synthetic somatostatin analogue for peptide drug design |
| Authors of publication | Fili, Stavroula; Valmas, Alexandros; Spiliopoulou, Maria; Kontou, Paraskevi; Fitch, Andrew; Beckers, Detlef; Degen, Thomas; Barlos, Kleomenis; Barlos, Kostas K.; Karavassili, Fotini; Margiolaki, Irene |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 4 |
| a | 18.5453 ± 0.0015 Å |
| b | 30.1766 ± 0.0025 Å |
| c | 39.798 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 22272 ± 3 Å3 |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| RFsqd | 0.31202 |
| Goodness-of-fit parameter for all reflections | 8.9 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.29995 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215999 (current) | 2019-06-15 | cif/ Adding structures of 2108428 via cif-deposit CGI script. |
2108428.cif |
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Users of the data should acknowledge the original authors of the
structural data.