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1 13C and 15N MAS spectra of both nanocrystals and fibrils
2 13C detected 2D 13C-13C spectroscopy is performed in the
3 13C flux analysis studies have become an essential compo
4 13C isotropic chemical shifts and backbone (phi, psi) to
5 13C labeling has been shown to greatly minimize matrix e
6 13C labeling studies performed in G. sulfurreducens indi
7 13C metabolic flux analysis (13C-MFA) has been widely us
8 13C NMR and stopped-flow kinetic experiments reveal that
9 13C relaxivity in C60 induced by nitroxide has also been
10 13C steady-state metabolic flux analysis showed that oxi
11 13C-13C Spin-spin coupling constants (JCC) have been mea
12 13C-Based metabolic flux analysis provides valuable info
13 13C-Glucose was dissolved in the test meal and 13CO2 det
14 13C-Isotopologue compositions of amino acids from bacter
15 sotope effects (AKIEs) of 1.0070 +/- 0.0002 (13C-AKIE, oxidation), 1.068 +/- 0.001 (13C-AKIE, S(N)2),
16 0002 (13C-AKIE, oxidation), 1.068 +/- 0.001 (13C-AKIE, S(N)2), and 1.0087 +/- 0.0002 (37Cl-AKIE, S(N)
17 amines directly in aqueous medium with 1,1'-13C(2) acetic anhydride is a simple method that creates
18 isotopic enrichment is higher than 99% for 1-13C (Phe), 2-2H (Phe), and 3,4-15N2 (cytidine), 93% for
20 m the (13)C incorporation from of infused [1-13C] glucose into glutamate [4-13C] relative to alanine
21 S, SPS, respectively) by incorporation of [1-13C]proline (using gas chromatography-mass spectrometry)
22 intermediates formed with the substrates, [1-13C]ethanolamine, [2-13C]ethanolamine, and unlabeled eth
23 e and exchange interactions as well as the 1-13C hyperfine splitting tensor were analyzed via spectra
24 the molecular addition of parahydrogen to 1-13C-fumaric acid-d2 and the subsequent transfer of spin
26 ps were performed on separate days, using [1-13C]glucose infusion to increase plasma 13C enrichment.
27 g in EPR spectra of samples prepared with [1-13C]ethanolamine and the absence of such splitting in sp
28 ning, leveraging data from approximately 100 13C-MFA papers on heterotrophic bacterial metabolisms.
32 n of cyclohexenone, while a much smaller 12C/13C isotope effect of 1.010 was observed at the C2 (alph
36 equence and exploiting differences in 1J 15N-13C coupling patterns to filter selected 15N resonances
38 ed at specific sites and two-dimensional 15N-13C and 13C-13C NMR spectra of samples that are uniforml
39 that allowed only the fungus access to a 15N/13C-labeled organic patch; in some cases, one plant was
42 ide chain, including isotope reporters (19F, 13C) that can be used in biophysical experiments such as
44 region of two-dimensional heteronuclear 1H, 13C NMR spectra of natural organic matter and related ma
45 ches the data reported for neopeltolide (1H, 13C, HRMS, IR, NOESY, [alpha]), thereby establishing the
46 mbines the experimental determination of 1H, 13C, and 15N chemical shifts by magic-angle spinning (MA
47 conductor nanocrystals was studied using 1H, 13C, and 31P NMR spectroscopy and mass spectrometry.
49 n example we measured a natural abundance 1H-13C HSQC spectrum of metabolites from granulocyte cell e
52 es, we have recorded ultrahigh-resolution 1H-13C HSQC NMR spectra of cell extracts, which exhibit spe
53 allows recording of ultrahigh resolution 1H-13C HSQC spectra in a fraction of the time needed for re
55 the hydroxyphenyl ring determined by the 1H-13C DIPSHIFT experiment indicate that the bond between t
58 with the substrates, [1-13C]ethanolamine, [2-13C]ethanolamine, and unlabeled ethanolamine were acquir
59 ability and fractional absorption of R-(+)[2-13C]equol were higher than those of S-(-)[2-13C]equol or
62 tting in spectra of samples prepared with [2-13C]ethanolamine show that the unpaired electron is loca
64 temperature-jump methods to develop a new 2D 13C-13C NMR experiment that yields a factor of 100-170 i
68 bisphosphonate drugs to human bone using 2H, 13C, 15N, and 31P nuclear magnetic resonance spectroscop
69 present, Envelope supports labeling with 2H, 13C, and 15N, and supports adjustments for baseline corr
72 of infused [1-13C] glucose into glutamate [4-13C] relative to alanine [3-13C] assessed by LC-tandem M
74 Adenines labeled at [6-13C], [6-15N], [6-13C, 6-15N], and [1-15N] were synthesized and enzymatica
76 PurE (AaPurE) and the active site ligand [6-13C]citrate probed a single ionization equilibrium assoc
77 of BACUS to the structure determination of a 13C unenriched protein for which no prior experimental 3
78 sign strategy that entails introduction of a 13C-atom (*) at specific sites of the porphyrins where t
82 In these 2D experiments, natural abundance 13C was observed from bicelles containing DMPC and DHPC
84 nhanced nuclear alignment) method to achieve 13C polarization of approximately 20% in seconds in 1-13
85 ltransferase (ST6Gal-I) to enzymatically add 13C-N-acetylneuraminic acid (NeuAc or sialic acid) to gl
86 ntration (cumulative percent of administered 13C dose recovered) in expiratory breath samples taken a
87 led by NMR coupling constants between alkyne 13C and 1H nuclei as well as between alkyne 13C and pyri
89 e found through 13C Metabolic Flux Analysis (13C MFA) for central carbon metabolism but, additionally
90 ellular fluxes, 13C Metabolic Flux Analysis (13C MFA), uses the labeling pattern obtained from metabo
91 uring fluxes by 13C metabolic flux analysis (13C-MFA) has become a key activity in chemical and pharm
93 ecific sites and two-dimensional 15N-13C and 13C-13C NMR spectra of samples that are uniformly 15N- a
94 y with 15N, species B uniformly with 15N and 13C, and species C uniformly with 15N but selectively wi
95 nd RNA with the NMR-active isotopes, 15N and 13C, opened the door to detailed analyses of macromolecu
97 timized experiment correlating 1HN, 15N, and 13C' resonances, referred to as c-TROSY-HNCO is presente
98 -15N HSQC spectra were recorded for 15N- and 13C-labeled murine amelogenin as a function of increasin
99 id state NMR spectra of a uniformly 15N- and 13C-labeled sample indicate that a relatively small frac
101 opy was essentially eliminated, while 1H and 13C chemical shift information could be derived quickly
102 c matter and related materials (e.g., 1H and 13C chemical shifts ranging from approximately 5 to 10 a
104 uctural investigations in solution by 1H and 13C NMR clearly showed scalar coupling of fluorine with
105 ons were found at low temperatures by 1H and 13C NMR for both formic acid and an adduct with hexafluo
107 tural elucidation by multidimensional 1H and 13C NMR spectroscopy revealed the accumulated metabolite
108 gnment to 35, undergirded by detailed 1H and 13C NMR studies, is consistent with proper transannular
109 ison of predicted chemical shifts for 1H and 13C with experimental values and with predictions of com
111 roups in the 6 position are shown by 6Li and 13C NMR spectroscopic studies to be monomers in THF.
112 xic or hypoxic (120 min only) conditions and 13C enrichment determined in the medium and cell extract
113 in the 1960s between pi-electron density and 13C shifts for classical 4n + 2 (n=0, 1, 2) pi-electron
114 The use of metabolite derivatization and 13C NMR spectroscopy produces data suitable for metaboli
115 the integration of extracellular fluxes and 13C enrichment measurements, HepatoDyn predicted that th
117 as made and converted to 13C-labeled GO, and 13C SSNMR was used to reveal details of the chemical bon
119 simultaneously because the observed NOEs and 13C(alpha) chemical shifts correspond to a dynamic ensem
120 knot structure, dynamics analyzed by RDC and 13C relaxation measurements, and base pair stability.
123 e chemistry was slowed for both [2H]PNP and [13C, 15N]PNP in proportion to their altered protein mass
124 dipole-dipole couplings in samples that are 13C-labeled at specific sites and two-dimensional 15N-13
126 way as through the standard amino acid based 13C MFA, and quantify the amount of information lost as
127 hemical shift and that of the directly bound 13C or 15N, is subsequently mapped to specific atoms in
132 ment of lactate production, as determined by 13C magnetic resonance spectroscopy (MRS) of hyperpolari
136 ne containing peptides that were modified by 13C iodoacetic acid showed a molecular weight that was 2
137 bile sites, most of which can be observed by 13C solid-state NMR even without magic-angle spinning.
138 followed by analysis of labeling patterns by 13C-NMR, confirmed an MVA-dependent biosynthesis; howeve
140 complex, the citrate central carboxylate C6 13C peak moves upfield, indicating diminution of negativ
142 ens TC1 (i) delivered highly characteristic (13C/12C, 15N/14N) fractionation trends for pathway ident
143 straints together with observed and computed 13C(alpha) chemical shifts, is applied to determine the
145 sites of mechanistic interest also contains 13C at all carbon positions, whereas the 16 O-labeled nu
146 ar couplings, C-H and N-H dipolar couplings, 13C chemical shift anisotropies, and 1H T1rho relaxation
147 ne cysteine of a double-cysteine mutant cTnC(13C/51C) as a FRET donor and attaching DDPM to the other
149 are manifested in the temperature-dependent 13C and 15N spectra, 13C-1H and 15N-1H dipolar couplings
151 rect dimensions, while the directly detected 13C' is doubly TROSY-optimized with respect to 1HN and 1
156 m metabolites (typically amino acids) during 13C labeling experiments to derive intracellular fluxes.
159 were perfused with buffer containing either 13C-palmitate plus glucose or (13)C glucose plus palmita
161 ve method of measuring intracellular fluxes, 13C Metabolic Flux Analysis (13C MFA), uses the labeling
162 to prepare chemically modified graphenes for 13C SSNMR analysis with enhanced sensitivity and for fun
164 lF2/CHCl2F/(CH3)2O) was larger than that for 13C-labeled methyl formate in the same solvent (0.2%), w
169 we use NMR distance restraints derived from 13C dipolar recoupling measurements to guide the simulat
171 hin several amino acid types determined from 13C chemical shifts is consistent with the ligand-free X
175 However, shorter tail ADs (G2-15C and G2-13C) and lower generation (G0 and G1) dendrimers failed
176 measurements of R1, R1rho, and heteronuclear 13C{1H} NOEs for protonated base (C2, C5, C6, and C8) an
177 rientation and dynamics of A-form helices in 13C/15N isotopically enriched RNA samples using NMR resi
178 ate the presence of an anionic intermediate, 13C isotope effect studies have been performed using the
181 contain synthetically incorporated isotopes (13C, 15N, etc) generating a distinct isotope pattern.
183 d (188)Os) and three unique 13C isotopomers (13C in ethylene, axial, and equatorial positions) were o
185 gment following helix E, experiences a large 13C shift corresponding to a conformational change of Il
186 nsion of this approach to accurately measure 13C-31P and 1H-31P couplings from phospholipids, which a
188 on, we have performed NMR studies on [methyl-13C]methionine-labeled UvrB from Bacillus caldotenax (mo
189 Critically, the dispersion is at natural 13C abundance; this matches typical pharmaceutical resea
190 spectroscopy of the brain to observe natural 13C abundance of N-acetylaspartate (NAA) and the appeara
191 bed including X-ray crystallography, 1H NMR, 13C NMR, HMQC, UV-visible, HPLC, MALDI-MS, and electroch
196 /NF1(333)-catalyzed hydrolysis of [beta18 O3,13C]GTP were determined by change in the isotope ratio o
197 the agreement between predicted and observed 13C(beta) chemical shifts, and some stereochemical quali
200 been derived that allows the calculation of 13C/12C ratios from the whole isotopic distributions, gi
201 scopy was used to measure the time course of 13C label incorporation into different metabolites and t
203 sensitivity, for which inverse detection of 13C and 15N signals with 1H is one promising approach.
204 4-bromostyrene) (PS/P4BrS), the diffusion of 13C-labeled PS has been investigated near the respective
208 ches can dramatically improve the quality of 13C-MFA results with important applications in metabolic
210 on from a protein offer a better sampling of 13C' CSA for different amino acid types in a complex het
217 rient containing 3-O-methylglucose (3-OMG), [13C]triolein, and [(99m)Tc]sulfur colloid was administer
222 (13C) = 25.8 +/- 5.1% (when produced) and %P(13C) = 14.2 +/- 0.7% (when imaged), T1 = 74 +/- 3 s), an
223 zed 1-(13)C-succinate-d2 (30 mM in water, %P(13C) = 25.8 +/- 5.1% (when produced) and %P(13C) = 14.2
225 directed isotope labeling scheme that places 13C with high efficiency and specificity at the nucleoti
230 ts is reflected in the carbon isotope ratio (13C/12C) in GTP or GDP, which is determined by the use o
231 re we extend to the protein-bound RNA recent 13C relaxation studies of motions in the RNA recognized
232 on predicted by our model agrees with recent 13C fluxomics experiments, and that our model largely re
237 However, the analysis of the site-specific 13C IR signals reveals distinct unfolding thermodynamics
239 e temperature-dependent 13C and 15N spectra, 13C-1H and 15N-1H dipolar couplings and 1H rotating-fram
240 onetheless, two-dimensional (2D) solid state 13C-13C NMR spectra of Rev filament and Rev-RNA coassemb
242 nance assignment that combines new strategic 13C labeling technologies with filter/edit type NOESY ex
244 previously measured by variable-temperature 13C CPMAS NMR and quadrupolar echo 2H NMR line-shape ana
252 relation between experimental shifts and the 13C NMR shifts calculated with density functional theory
254 MR and quantum chemical investigation of the 13C gamma NMR chemical shifts in phenylalanine and tyros
256 The orientation of the principal axes of the 13C hyperfine splitting tensor shows that the long axis
263 ew method are similar to those found through 13C Metabolic Flux Analysis (13C MFA) for central carbon
264 C-labeled graphite was made and converted to 13C-labeled GO, and 13C SSNMR was used to reveal details
265 ling experiments is of central importance to 13C-MFA as it determines the precision with which fluxes
269 ng the conversion of hyperpolarized [U-2H, U-13C]glucose to lactate using 13C magnetic resonance spec
273 -to-nanosecond internal motions in uniformly 13C/15N-labeled RNAs that combines measurements of R1, R
274 NMR spectra were collected on uniformly 13C and 15N isotopically enriched, polyethylene glycol p
275 chemes using the fully protonated, uniformly 13C,15N-labeled protein GB1 at 40 kHz MAS rate with 1.6-
276 mall-cell lung cancer (NSCLC) with uniformly 13C-labeled glucose before tissue resection and determin
277 ine global secondary structure in uniformly (13C,15N)-enriched systems by simultaneously measuring di
278 2)Os, (190)Os, and (188)Os) and three unique 13C isotopomers (13C in ethylene, axial, and equatorial
284 arized [U-2H, U-13C]glucose to lactate using 13C magnetic resonance spectroscopy and spectroscopic im
286 a gastric emptying test by breath test using 13C octanoic acid coupled to a solid meal and answered a
288 etics of S-(-)equol and R-(+)equol by using [13C] stable-isotope-labeled tracers to facilitate the op
289 Chemical shift dispersion due to the various 13C-NeuAc adducts on ST6Gal-I was observed in a 3D exper
290 epatic metabolism was analyzed using in vivo 13C/31P/1H and ex vivo 2H magnetic resonance spectroscop
294 thynylbiphenyl at natural abundance and with 13C[triple bond]13CH and 15N[triple bond]C labeling is d
295 d methyl aldopyranosides singly labeled with 13C at different sites to confirm and extend prior corre
296 d melanotic melanoma cells were labeled with 13C precursors and changes in their metabolism was analy
297 and Ala residues are uniformly labeled with 13C, are nearly indistinguishable, indicating that the p
298 tyl groups in isolated native oligomers with 13C labeled acetyl groups and the extraction of orientat
300 Nuclear magnetic resonance experiments with [13C]formate, as well as 14C-labeling experiments, demons
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