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
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.