Information card for entry 1575645

Structure parameters

• Chemical name: metal–peptide double helical β-sheet tape (Val, Val)
• Formula: C35.58 H51 Ag F4.72 N7.79 O11.65 S1.57
• Calculated formula: C35.575 H49 Ag F4.725 N7.7875 O11.65 S1.575
• 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: 25.794 ± 0.004 Å
• b: 25.794 ± 0.004 Å
• c: 50.545 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 29124 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1946
• Weighted residual factors for all reflections included in the refinement: 0.1992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No