Information card for entry 2017528

Structure parameters

• Common name: glycyl-methionine sulfoxide hydrogen tetrachloroaurate
• Chemical name: ({(1<i>S</i>,<i>R</i>)-1-carboxy-3-[(<i>R</i>,<i>S</i>)-methylsulfinyl]propyl}aminocarbonyl)methanaminium tetrachloridoaurate(III)
• Formula: C7 H15 Au Cl4 N2 O4 S
• Calculated formula: C7 H15 Au Cl4 N2 O4 S
• Title of publication: Crystallographic evidence of Gly-<small>D</small>,<small>L</small>-Met oxidation to its sulfoxide in the presence of gold(III): solid solution of the racemic mixture of two diastereoisomers
• Authors of publication: Rychlewska, Urszula; Warzajtis, Beata; Glisic, Biljana D.; Rajkovic, Snezana; Djuran, Miloš
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: m51 - m54
• a: 7.625 ± 0.0005 Å
• b: 10.2576 ± 0.0004 Å
• c: 10.716 ± 0.0007 Å
• α: 95.281 ± 0.004°
• β: 107.222 ± 0.006°
• γ: 92.001 ± 0.004°
• Cell volume: 795.46 ± 0.08 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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 all reflections: 0.0168
• Residual factor for significantly intense reflections: 0.0159
• Weighted residual factors for significantly intense reflections: 0.0411
• Weighted residual factors for all reflections included in the refinement: 0.0415
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes