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[Formuleweb-announce] untiring grounding


From: Lewie Blanton
Subject: [Formuleweb-announce] untiring grounding
Date: Wed, 27 Sep 2006 09:49:55 +0900

carbonyl interaction. carbonyl interaction.
Neighbouring parallel chains are crosslinked by water molecules, resulting in a three-dimensional architecture. Both the major and minor conformers of the pyrrolidine ring adopt conformations intermediate between a half-chair and an envelope.
The molecules are crosslinked by nine hydrogen bonds into layers parallel with the ac plane. The results confirm the lower symmetry assigned in a previous single-crystal neutron diffraction study. O interactions involving the methyl and CH groups, and the sulfonyl O atoms of the acesulfamate group. Neighbouring parallel chains are crosslinked by water molecules, resulting in a three-dimensional architecture. Reports on new protein structures are particularly encouraged, as are papers on crystallographic binding studies, structural analysis of mutants and other structure-function studies. In structures of NA determined previously, a calcium ion is observed to coordinate amino acids near the substrate-binding site. In structures of NA determined previously, a calcium ion is observed to coordinate amino acids near the substrate-binding site. The asymmetric unit consists of one complete thiourea molecule and one-half of a dimethyl oxalate molecule lying on an inversion centre. Rods of weak diffuse scattering confirm the stacking model. O hydrogen bonds to two different trichlate ions.
Papers on the crystallization of biological molecules will be accepted providing that these focus on new methods or other features that are of general importance or applicability.
The strong hydrogen bonds link molecules in finite chains, with hydroxyl O atoms acting as both donors and acceptors of hydroxyl H atoms. The published paper contains an encapsulation of the data that are essential to understanding the main features of the study. O hydrogen bonds and a two-centre iodo.
O hydrogen bonds, thus interconnecting the chains of thiourea molecules to form completely connected sheets.
Adjacent chains are arranged in a cross-like fashion around the mid-point of the bipy ligands, resulting in a three-dimensional supramolecular array. The striking feature in both crystal packings is that they do not contain the expected conventional hydrogen bonds, in spite of the presence of good hydrogen-bonding functionalities.
The silole ligands present a propeller-like arrangement of the benzene rings around the Si-containing five-membered ring. S interactions, and is affected by the alkyl-chain lengths.
The dihedral angles between the complexed nitroxides and the benzene rings to which they are bound are smaller than those found in the free ligand.
O hydrogen bonds, together with a two-centre iodo. Papers on crystallographic methods should be oriented towards biological crystallography, and may include new approaches to any aspect of structure determination or analysis.
The molecules are stacked in dimers with antiparallel dipoles. Nevertheless, the molecule remains conjugated, with a shortening of the same bonds as in DANS.

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