Information card for entry 4117619

Structure parameters

• Formula: C25 H37 N O15 S
• Calculated formula: C25 H37 N O15 S
• Title of publication: Glycopolypeptides with a Redox-Triggered Helix-to-Coil Transition
• Authors of publication: Jessica R. Kramer; Timothy J. Deming
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 4112 - 4115
• a: 12.622 ± 0.003 Å
• b: 5.2414 ± 0.0014 Å
• c: 22.052 ± 0.006 Å
• α: 90°
• β: 93.864 ± 0.003°
• γ: 90°
• Cell volume: 1455.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0934
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.168
• Weighted residual factors for all reflections included in the refinement: 0.1826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No