Information card for entry 2313077

Structure parameters

• Formula: C63 Co N14 O28 P
• Calculated formula: C63 Co N14 O28 P
• Title of publication: Single-crystal X-ray and in crystallo XANES studies resolve cobalt coordination in cobalamin and rule out radiation-induced ligand loss in human intrinsic factor.
• Authors of publication: Sukumar, Narayanasami; Alpers, David H.; Sterbinsky, George E.; Sukumar, Sahana L.
• Journal of publication: Acta crystallographica. Section D, Structural biology
• Year of publication: 2026
• Journal volume: 82
• Journal issue: 10
• a: 16.367 ± 0.016 Å
• b: 21.35 ± 0.02 Å
• c: 25.2 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8806 ± 16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1791
• Residual factor for significantly intense reflections: 0.177
• Weighted residual factors for significantly intense reflections: 0.3814
• Weighted residual factors for all reflections included in the refinement: 0.3837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.892
• Diffraction radiation wavelength: 0.98 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No