Search results for "MOLECULE"

showing 10 items of 5162 documents

Human neuroglobin: crystals and preliminary X-ray diffraction analysis

2002

Neuroglobin, a recently discovered member of the haemoglobin superfamily, is primarily expressed in the brain of humans and other vertebrates, where it has been proposed to enhance O(2) supply in response to hypoxia or ischaemia, protecting the neuron from hypoxic injury. Neuroglobin is the first example of a vertebrate haemoglobin in which a hexacoordinate haem geometry has been detected. A triple mutant (replacing three Cys residues) of human neuroglobin (151 amino acids) has been expressed in Escherichia coli, purified and crystallized in two crystal forms, the best of which diffracts to 1.95 A resolution using synchrotron radiation. The crystals belong to space group P2(1), with unit-ce…

chemistry.chemical_classificationCrystallographyProtein moleculesResolution (electron density)HexacoordinateNeuroglobinNerve Tissue ProteinsGeneral MedicineBiologymedicine.disease_causeRecombinant ProteinsAmino acidGlobinsCrystalCrystallographychemistryX-Ray DiffractionStructural BiologyNeuroglobinX-ray crystallographymedicineHumansEscherichia coli
researchProduct

1991

The sanidic polyamide [NM-Ph(CO 2 R) 3 (CO 2 Me)-NMCO-Ph(OR) 2 CO] n (R=C 12 H 25 ) is studied. It is shown that this polymer has a biaxial structure with quasi 2-D long range translational correlations. The correlations in one direction are limited by the length of the molecule. The oriented regions are separated by regions in which the molecules are less oriented

chemistry.chemical_classificationCrystallographyRange (particle radiation)High resolution electron microscopychemistrylawLiquid crystalPolyamideMoleculePolymerElectron microscopelaw.inventionDie Makromolekulare Chemie, Rapid Communications
researchProduct

Deuteron NMR Relaxation Studies of Combined Main-Chain/Side-Chain Polymers in the Liquid Crystalline and Glassy State

1989

Etude du polymere [O−Ph−CO 2 −Ph(R)−O−CO−Ph−O-(CH 2 ) 10 −] n (R=(CH 2 ) 6 −O−Ph−N=N−Ph−OMe) qui est caracterise par des parametres d'ordre des mesogenes de la chaine principale tres superieurs a ceux des chaines laterales. On observe une biaxialite moleculaire dans toutes les mesophases et dans la phase smectique A

chemistry.chemical_classificationCrystallographychemistryChain (algebraic topology)DeuteriumLiquid crystallineStereochemistryLiquid crystalGeneral Chemical EngineeringMolecular motionSide chainMoleculePolymerBerichte der Bunsengesellschaft für physikalische Chemie
researchProduct

Ethanedithiol diacetate

2001

Ethane-1,2-diyl S,S′-bis­(thio­acetate), H3CC(O)SCH2CH2SC(O)CH3 or C6H10O2S2, forms centrosymmetric mol­ecules in the solid state and the molecular structure determined by X-ray crystallography is in good agreement with that obtained by density functional geometry optimization. The planarity of the O=C—S—C fragment, which is also found in structures of other thio­acetates, is attributed to a strong np(S)–π*(C—O) orbital interaction.

chemistry.chemical_classificationCrystallographychemistryFragment (logic)ThiolSolid-stateMoleculeGeneral Materials ScienceGeneral ChemistryCondensed Matter PhysicsEnergy minimizationPlanarity testingActa Crystallographica Section E Structure Reports Online
researchProduct

Small-Angle Scattering Techniques for Analyzing Conformational Transitions in Hemocyanins

2004

Publisher Summary The precise delivery of oxygen from respiratory surfaces to the tissues is mediated by cooperative and allosterically regulated carrier proteins, such as hemoglobin or hemocyanin. To establish cooperativity, these proteins must be able to adopt different conformations. These conformations are characterized by different ligand affinities, which have their basis in different structures as is the case for the deoxy and oxy states of human hemoglobin. To understand the cooperative interaction of these molecules at the molecular level, the structures of these conformations must be resolved and the transitions between them must be monitored. Because of the nature of sample prepa…

chemistry.chemical_classificationCrystallographychemistrySmall-angle X-ray scatteringScatteringBiomoleculeResolution (electron density)MoleculeCooperativityNeutron scatteringSmall-angle scattering
researchProduct

Das erste verklammerte und stark deformierte Adamantan

1990

chemistry.chemical_classificationCrystallographychemistry.chemical_compoundHydrocarbonMaterials sciencechemistryX-ray crystallographyMoleculeGeneral MedicineNuclear magnetic resonance spectroscopyCrystal structurePyrolysisCyclophaneAngewandte Chemie
researchProduct

Influence of Cyclodextrin Molecules on the Synthesis and the Thermoresponsive Solution Behavior of N-Isopropylacrylamide Copolymers with Adamantyl Gr…

2003

chemistry.chemical_classificationCyclodextrinChemistryPolymer chemistrySide chainCopolymerOrganic chemistryMoleculeGeneral ChemistryCatalysisAngewandte Chemie International Edition
researchProduct

Volume and heat capacity studies to evidence interactions between cyclodextrins and nicotinic acid in water

2008

Density and heat capacity of the water+cyclodextrin (CD), water+nicotinic acid (NA) and water+CD+NA mixtures were determined at 298.15 K. CDs with different cavity size and alkylation were selected. From the experimental data the apparent molar properties were calculated. Assuming the formation of inclusion complexes of 1:1 stoichiometry, these properties were modeled and provided the stability constants of CD/NA inclusion complexes and the corresponding property change. The binding of NA with the smallest sized alpha-cyclodextrin (alpha-CD) generates more stable complexes accompanied by the lower volume and the heat capacity changes. These results are in agreement with earlier proposed bin…

chemistry.chemical_classificationCyclodextrinChemistryStereochemistryapparent molar heat capacityCondensed Matter PhysicsHeat capacityInclusion compoundchemistry.chemical_compoundB vitaminsMolar volumecyclodextrinVolume (thermodynamics)MoleculePhysical chemistryinclusion complex formationnicotinic acidPhysical and Theoretical ChemistryStoichiometryapparent molar volumeJournal of Thermal Analysis and Calorimetry
researchProduct

Binding equilibria between beta-cyclodextrin and p-nitro-aniline derivatives: the first systematic study in mixed water-methanol solvent systems.

2009

Abstract Complexation equilibria, in mixed water–methanol solvent media, between native β-cyclodextrin and a set of suitably selected p -nitro-aniline derivatives were studied by means of polarimetry. The effects exerted by the organic co-solvent on the conditional inclusion free energies Δ G cond 0 and the differential molar optical rotations Δ Θ were thoroughly analyzed under the perspective of the enthalpy–entropy compensation effect. Experimental data suggest an intimate participation (‘dynamic co-inclusion’) of solvent molecules in the formation and in the conformational dynamics of the host–guest inclusion complex.

chemistry.chemical_classificationCyclodextrinOrganic ChemistryEnthalpyNitro compoundSettore CHIM/06 - Chimica OrganicaBiochemistryCyclodextrin host-guest complexes polarimetryInclusion compoundSolventchemistry.chemical_compoundAnilinechemistryComputational chemistryDrug DiscoveryNitroMoleculeOrganic chemistry
researchProduct

Chiral recognition of protected amino acids by means of fluorescent binary complex pyrene/heptakis-(6-amino)-(6-deoxy)-β-cyclodextrin

2006

The ability of the binary complex pyrene (Py)/heptakis-(6-amino)-(6-deoxy)-β-cyclodextrin (am-β-CD) to act as a chiral selector was tested at two pH values (8.0 and 9.0). Phenylalanine (Phe), methionine (Met) and histidine (His) were used as chiral model molecules. The stability of ternary complexes Py/am-β-CD/amino acid was determined by means of spectrofluorimetric measurements. The data collected showed an increase in stability going from the binary to ternary complex and above all the possibility to use the binary complex as a chiral selector. Finally, data collected at two pH values showed that the binary complex is a better chiral selector when charged rather than in its neutral form.

chemistry.chemical_classificationCyclodextrinStereochemistryOrganic ChemistryPhenylalanineSettore CHIM/06 - Chimica OrganicaBiochemistryAmino acidchemistry.chemical_compoundchemistryDrug DiscoveryMoleculePyreneTernary operationTernary complexaminoacid chiral recognition cyclodextrinHistidineTetrahedron
researchProduct