Information card for entry 7114028

Structure parameters

• Formula: C33 H48 Eu F15 K2 N8 O27 S5
• Calculated formula: C33 H48 Eu F15 K2 N8 O27 S4.98
• Title of publication: Rapid hydrolytic cleavage of the mRNA model compound HPNP by glycine based macrocyclic lanthanide ribonuclease mimicsElectronic supplementary information (EI) available: full experimental details, Fig. S1???S6. See http://www.rsc.org./suppdata/cc/b2/b205349g/
• Authors of publication: Gunnlaugsson, Thorfinnur; Davies, R. Jeremy H.; Nieuwenhuyzen, Mark; Stevenson, Clarke S.; Viguier, Romain; Mulready, Sinead
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 18
• Pages of publication: 2136
• a: 17.2721 ± 0.0008 Å
• b: 17.2721 ± 0.0008 Å
• c: 21.0475 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6279 ± 0.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 8
• Space group number: 130
• Hermann-Mauguin space group symbol: P 4/n c c :2
• Hall space group symbol: -P 4a 2ac
• Residual factor for all reflections: 0.0731
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1366
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No