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CIF Information Card
Information card for 7151824
7151823 << 7151824 >> 7151825Preview
|
Coordinates |
7151824.cif |
Structure parameters
| Common name | Boc-(Leu-Leu-RR)3-OMe |
| Chemical name | Boc-(Leu-Leu-RR)3-OMe |
| Formula | - C133 H248 N18 O42 - |
| Calculated formula | - C133 H248 N18 O42 - |
| Title of publication | Conformational studies on peptides containing α,α-disubstituted α-amino acids: chiral cyclic α,α-disubstituted α-amino acid as an α-helical inducer. |
| Authors of publication | Demizu, Yosuke; Doi, Mitsunobu; Kurihara, Masaaki; Okuda, Haruhiro; Nagano, Masanobu; Suemune, Hiroshi; Tanaka, Masakazu |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 9 |
| Pages of publication | 3303 - 3312 |
| a | 11.5605 ± 0.0012 Å |
| b | 45.42 ± 0.005 Å |
| c | 15.286 ± 0.0016 Å |
| α | 90° |
| β | 95.515 ± 0.002° |
| γ | 90° |
| Cell volume | 7989.2 ± 1.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21 1 |
| Hall symmetry space group | P 2yb |
| Residual factor for all reflections | 0.097 |
| Residual factor for observed reflections | 0.0859 |
| Weighted residual factors for the observed reflections | 0.237 |
| Weighted residual factors for all reflections included in the refinement | 0.2503 |
| Goodness-of-fit parameter for observed reflections | 1.096 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |