Information card for entry 7130076

Structure parameters

• Formula: C60 H66 N8 O8
• Calculated formula: C60 H66 N8 O8
• Title of publication: Atomic insight into short helical peptide comprised of consecutive multiple aromatic residues
• Authors of publication: Misra, Rajkumar; Vijayakanth, Thangavel; Shimon, Linda J. W.; Adler-Abramovich, Lihi
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 11.9093 ± 0.0002 Å
• b: 11.9093 ± 0.0002 Å
• c: 68.9715 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8471.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1627
• Weighted residual factors for all reflections included in the refinement: 0.1751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No