Information card for entry 7025180

Structure parameters

• Formula: C64 H86 F12 N8 O12 P2 Zn4
• Calculated formula: C64 H86 F12 N8 O12 P2 Zn4
• 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: 24.508 ± 0.0005 Å
• b: 14.4476 ± 0.0003 Å
• c: 21.2277 ± 0.0003 Å
• α: 90°
• β: 93.315 ± 0.001°
• γ: 90°
• Cell volume: 7503.8 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1301
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No