Information card for entry 4113764

Structure parameters

• Formula: C8 H15 N O5
• Calculated formula: C8 H15 N O5
• SMILES: O=C(OC)[C@H]1N(CC[C@@H]1O)C(=O)C.O
• Title of publication: Effect of 3-Hydroxyproline Residues on Collagen Stability
• Authors of publication: Cara L. Jenkins; Lynn E. Bretscher; Ilia A. Guzei; Ronald T. Raines
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 6422 - 6427
• a: 6.1545 ± 0.0006 Å
• b: 8.305 ± 0.0009 Å
• c: 20.807 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1063.51 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0401
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.0975
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No