Information card for entry 7025182

Structure parameters

• Formula: C104 H146 F48 N16 O17 P8
• Calculated formula: C104 H146 F48 N16 O17 P8
• Title of publication: Unsymmetrical dizinc complexes as models for the active sites of phosphohydrolases.
• Authors of publication: Jarenmark, Martin; Csapó, Edit; Singh, Jyoti; Wöckel, Simone; Farkas, Etelka; Meyer, Franc; Haukka, Matti; Nordlander, Ebbe
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 35
• Pages of publication: 8183 - 8194
• a: 14.267 ± 0.0009 Å
• b: 14.3112 ± 0.001 Å
• c: 18.2423 ± 0.0012 Å
• α: 67.849 ± 0.004°
• β: 87.856 ± 0.003°
• γ: 69.826 ± 0.003°
• Cell volume: 3219.7 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1893
• Residual factor for significantly intense reflections: 0.0863
• Weighted residual factors for significantly intense reflections: 0.1691
• Weighted residual factors for all reflections included in the refinement: 0.213
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No