CRYSTAL-STRUCTURES OF HYDROPHOBIC AMINO-ACIDS .1. REDETERMINATIONS OFL-METHIONINE AND L-VALINE AT 120 K

Citation
B. Dalhus et Ch. Gorbitz, CRYSTAL-STRUCTURES OF HYDROPHOBIC AMINO-ACIDS .1. REDETERMINATIONS OFL-METHIONINE AND L-VALINE AT 120 K, Acta chemica Scandinavica, 50(6), 1996, pp. 544-548
Citations number
16
Categorie Soggetti
Chemistry,Biology
Journal title
ISSN journal
0904213X
Volume
50
Issue
6
Year of publication
1996
Pages
544 - 548
Database
ISI
SICI code
0904-213X(1996)50:6<544:COHA.R>2.0.ZU;2-2
Abstract
The crystal structures of L-methionine and L-valine have been redeterm ined by X-ray diffraction methods at 120 K. Both compounds crystallize in the monoclinic space group P2(1), Z=4, with lattice parameters a=9 .493(2), b=5.201(2), c=14.831(3) Angstrom, beta=99.84(2)degrees for L- Met and a=9.682(2), b=5.247(1), c=11.930(2) Angstrom, beta=90.57(1)deg rees for L-Val. The least squares refinements converged at R=0.037, R( W)=0.038 for L-Met and R=0.034, R(W)=0.038 for L-Val. The structure fa ctors for L-Met were empirically corrected for absorption. The overall geometries agree with the original structure determinations, but the standard deviations for geometric parameters have been reduced by a fa ctor between 4 and 10. Also, positional parameters for all hydrogen at oms have been refined, allowing a detailed study of the hydrogen bond patterns.