Information card for entry 1575646

Structure parameters

• Chemical name: metal–peptide helical β-sheet tape (Val, Val) with C12
• Formula: C46.63 H71.33 Ag0.92 F4.9 N7.82 O11.43 S1.63
• Calculated formula: C46.6333 H71 Ag0.916667 F4.9 N7.81667 O11.4333 S1.63333
• 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: 24.635 ± 0.007 Å
• b: 44.065 ± 0.012 Å
• c: 103.3 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 112136 ± 5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.3468
• Residual factor for significantly intense reflections: 0.1885
• Weighted residual factors for significantly intense reflections: 0.4201
• Weighted residual factors for all reflections included in the refinement: 0.511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.285
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No