Information card for entry 2311623

Structure parameters

• Formula: C26 H44 N8 O14 Ru S
• Calculated formula: C26 H24 N8 O14 Ru S
• Title of publication: Structures of ruthenium-modified Pseudomonas aeruginosa azurin and [Ru(2,2'-bipyridine)2(imidazole)2]SO4 x 10H2O.
• Authors of publication: Faham, S.; Day, M. W.; Connick, W. B.; Crane, B. R.; Di Bilio, A. J.; Schaefer, W. P.; Rees, D. C.; Gray, H. B.
• Journal of publication: Acta crystallographica. Section D, Biological crystallography
• Year of publication: 1999
• Journal volume: 55
• Journal issue: Pt 2
• Pages of publication: 379 - 385
• a: 13.23 ± 0.002 Å
• b: 18.197 ± 0.004 Å
• c: 16.126 ± 0.004 Å
• α: 90°
• β: 108.65 ± 0.02°
• γ: 90°
• Cell volume: 3678.4 ± 1.4 ų
• Cell temperature: 297 K
• Ambient diffraction temperature: 297 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0907
• Residual factor for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections: 0.17
• Weighted residual factors for significantly intense reflections: 0.17
• Goodness-of-fit parameter for all reflections: 3.53
• Goodness-of-fit parameter for significantly intense reflections: 3.53
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No