Information card for entry 1575642

Structure parameters

• Chemical name: metal–peptide double helical β-sheet tape (Val, Tle)
• Formula: C36.35 H53 Ag F4.05 N7.67 O11.7 S1.35
• Calculated formula: C36.35 H51 Ag F4.05 N7.675 O11.7 S1.35
• Title of publication: Engineering β-sheet morphologies <i>via</i> metal cross-linking and side chain modifications.
• Authors of publication: Tsunekawa, Eisuke; Nakama, Takahiro; Fujita, Makoto; Sawada, Tomohisa
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 40
• Pages of publication: 18832 - 18837
• a: 32.1 ± 0.02 Å
• b: 32.1 ± 0.02 Å
• c: 90.47 ± 0.07 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 80732 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 178
• Hermann-Mauguin space group symbol: P 61 2 2
• Hall space group symbol: P 61 2 (0 0 5)
• Residual factor for all reflections: 0.2392
• Residual factor for significantly intense reflections: 0.1848
• Weighted residual factors for significantly intense reflections: 0.4253
• Weighted residual factors for all reflections included in the refinement: 0.4788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.272
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No