Information card for entry 2102088

Structure parameters

• Formula: C13 H19 N3 O6
• Calculated formula: C13 H19 N3 O6
• Title of publication: Electron density and electrostatic properties of two peptide molecules: tyrosyl-glycyl-glycine monohydrate and glycyl-aspartic acid dihydrate
• Authors of publication: Pichon-Pesme, Virginie; Lachekar, Hassane; Souhassou, Mohamed; Lecomte, Claude
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 4
• Pages of publication: 728 - 737
• a: 7.984 ± 0.002 Å
• b: 9.535 ± 0.003 Å
• c: 18.352 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1397.1 ± 0.7 ų
• 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
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No