Crystallography Open Database

Information card for entry 2103745

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Structure parameters

Common name	L-Arginine-Glutaricacid-complex
Formula	C17 H40 N8 O10
Calculated formula	C17 H40 N8 O10
SMILES	[NH3+][C@H](C(=O)[O-])CCCNC(=[NH2+])N.O.C(=O)(CCCC(=O)[O-])[O-].C(=O)([C@H](CCCNC(=[NH2+])N)[NH3+])[O-].O
Title of publication	X-ray studies on crystalline complexes involving amino acids and peptides. XXXVIII. Crystal structures of the complexes of <small>L</small>-arginine and <small>L</small>-histidine with glutaric acid and a comparative study of amino acid‒glutaric acid complexes
Authors of publication	Saraswathi, N. T.; Vijayan, M.
Journal of publication	Acta Crystallographica Section B
Year of publication	2001
Journal volume	57
Journal issue	6
Pages of publication	842 - 849
a	19.008 ± 0.003 Å
b	5.073 ± 0.002 Å
c	13.6723 ± 0.0019 Å
α	90°
β	101.109 ± 0.013°
γ	90°
Cell volume	1293.7 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0746
Residual factor for significantly intense reflections	0.0534
Weighted residual factors for all reflections included in the refinement	0.1581
Goodness-of-fit parameter for all reflections included in the refinement	1.11
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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