Information card for entry 1575640

Structure parameters

• Chemical name: metal–peptide helical β-sheet tape (Thr, Tle)
• Formula: C35 H50 Ag F3 N7.5 O11.5 S
• Calculated formula: C35 H49 Ag F3 N7.5 O11.5 S
• 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: 22.89 ± 0.03 Å
• b: 22.89 ± 0.03 Å
• c: 51.99 ± 0.05 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 27240 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 95
• Hermann-Mauguin space group symbol: P 43 2 2
• Hall space group symbol: P 4cw 2c
• Residual factor for all reflections: 0.3066
• Residual factor for significantly intense reflections: 0.1939
• Weighted residual factors for significantly intense reflections: 0.4502
• Weighted residual factors for all reflections included in the refinement: 0.5295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.298
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No