Information card for entry 4340175

Structure parameters

• Formula: C70.5 H71 Cl4 Cu2 N7 O16 P
• Calculated formula: C70.5 H64 Cl4 Cu2 N7 O16 P
• Title of publication: Dinuclear copper(II) complexes with {Cu2(mu-hydroxo)bis(mu-carboxylato)}+ cores and their reactions with sugar phosphate esters: A substrate binding model of fructose-1,6-bisphosphatase.
• Authors of publication: Kato, Merii; Tanase, Tomoaki; Mikuriya, Masahiro
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 7
• Pages of publication: 2925 - 2941
• a: 16.564 ± 0.007 Å
• b: 18.324 ± 0.005 Å
• c: 13 ± 0.004 Å
• α: 98.28 ± 0.02°
• β: 102.98 ± 0.03°
• γ: 98.08 ± 0.03°
• Cell volume: 3743 ± 2 ų
• Cell temperature: 155.2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.1528
• Goodness-of-fit parameter for all reflections included in the refinement: 2.903
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No