Literature DB >> 27377274

A phase transition from monoclinic C2 with Z' = 1 to triclinic P1 with Z' = 4 for the quasiracemate L-2-aminobutyric acid-D-methionine (1/1).

Carl Henrik Görbitz1, David S Wragg1, Ingrid Marie Bergh Bakke1, Christian Fleischer1, Gaute Grønnevik1, Maria Mykland1, Yoomin Park1, Kristian Wiedicke Trovik1, Halvard Serigstad1, Bård Edgar Vestheim Sundsli1.   

Abstract

Racemates of hydrophobic amino acids with linear side chains are known to undergo a unique series of solid-state phase transitions that involve sliding of molecular bilayers upon heating or cooling. Recently, this behaviour was shown to extend also to quasiracemates of two different amino acids with opposite handedness [Görbitz & Karen (2015). J. Phys. Chem. B, 119, 4975-4984]. Previous investigations are here extended to an L-2-aminobutyric acid-D-methionine (1/1) co-crystal, C4H9NO2·C5H11NO2S. The significant difference in size between the -CH2CH3 and -CH2CH2SCH3 side chains leads to extensive disorder at room temperature, which is essentially resolved after a phase transition at 229 K to an unprecedented triclinic form where all four D-methionine molecules in the asymmetric unit have different side-chain conformations and all three side-chain rotamers are used for the four partner L-2-aminobutyric acid molecules.

Entities:  

Keywords:  crystal structure; d-methionine; disorder; l-2-aminobutyric acid; phase transition; quasiracemate; steric conflict

Year:  2016        PMID: 27377274     DOI: 10.1107/S2053229616008858

Source DB:  PubMed          Journal:  Acta Crystallogr C Struct Chem        ISSN: 2053-2296            Impact factor:   1.172


  2 in total

1.  An exceptional series of phase transitions in hydrophobic amino acids with linear side chains.

Authors:  Carl Henrik Görbitz; Pavel Karen; Michal Dušek; Václav Petříček
Journal:  IUCrJ       Date:  2016-08-09       Impact factor: 4.769

2.  On the mechanism of solid-state phase transitions in molecular crystals - the role of cooperative motion in (quasi)racemic linear amino acids.

Authors:  M M H Smets; E Kalkman; A Krieger; P Tinnemans; H Meekes; E Vlieg; H M Cuppen
Journal:  IUCrJ       Date:  2020-02-27       Impact factor: 4.769

  2 in total

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