Information card for entry 7218318

Structure parameters

• Formula: C20 H40 N7 O15 Tb
• Calculated formula: C20 H40 N7 O15 Tb
• Title of publication: The first example of model compound of RNase U2 and its intermediate with CPP directly monitored by ESI-MS
• Authors of publication: Ma, Xiaoyan; Yin, Yuxin; Geng, Zhirong; Yang, Zhen; Wen, Jinghan; Wang, Zhilin
• Journal of publication: RSC Adv.
• Year of publication: 2014
• a: 10.3057 ± 0.0014 Å
• b: 10.4576 ± 0.0012 Å
• c: 16.047 ± 0.002 Å
• α: 92.087 ± 0.002°
• β: 99.182 ± 0.003°
• γ: 116.38 ± 0.002°
• Cell volume: 1518.2 ± 0.3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0648
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No