Information card for entry 4102923

Structure parameters

• Formula: C83 H115 Br N19 O23
• Calculated formula: C338 Br2.65 N75.9 O182
• Title of publication: X-ray Crystallographic Structure of an Artificial β-Sheet Dimer
• Authors of publication: Omid Khakshoor; Aaron J. Lin; Tyler P. Korman; Michael R. Sawaya; Shiou-Chuan Tsai; David Eisenberg; James S. Nowick
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 11622 - 11628
• a: 64.04 ± 0.06 Å
• b: 64.19 ± 0.06 Å
• c: 64.25 ± 0.06 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 264114 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1504
• Diffraction radiation wavelength: 0.97853 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No