title: Identification of bound water molecules in the cyclic tetrasaccharide, cyclo-{-->6}-alpha-d-Glcp-(1-->3)-alpha-D-Glcp-(1-->6)-alpha-D-Glcp-(1-->3)-alpha-D-Glcp-(1-->).
abstract: A structural characterization of bound water molecules in the cyclic tetrasaccharide, cyclo-{-->6}-alpha-D-Glcp-(1-->3)-alpha-D-Glcp-(1-->6)-alpha-D-Glcp-(1-->3)-alpha-D-Glcp-(1-->), was carried out by NMR spectroscopy. H-1', 2'-OH, H-3', and 4'-OH of the 3-O-glycosylated residue and H-1 of the 6-O-glycosylated residue were found to cross-relax with protons of bound waters using the double-pulsed field-gradient spin-echo ROESY experiment. In the crystal structure, one water molecule is located in the center of the plate, and its temperature factor is very low, indicating that this water molecule is an intrinsic component.
authors: Division of Agriculture and Agricultural Life Sciences, The University of Tokyo, Yayoi, Bunkyo-ku, Tokyo 113-8657, Japan.
authors: Kazuo
authors: K
authors: Furihata
authors: Takashi
authors: T
authors: Fujimoto
authors: Ayumi
authors: A
authors: Tsutsui
authors: Tomoya
authors: T
authors: Machinami
authors: Mitsuru
authors: M
authors: Tashiro
mesh_terms: D002240:Carbohydrate Sequence; D003505:Cyclodextrins / Q000737:chemistry*; D019906:Nuclear Magnetic Resonance, Biomolecular / Q000379:methods; D009844:Oligosaccharides / Q000737:chemistry*; D014867:Water / Q000737:chemistry*
chemical_list: D003505:Cyclodextrins; D009844:Oligosaccharides; C421202:cyclo-tetra-glucose; D014867:Water