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1 ly, and significant narrowing of the His-258 cross-peak.
2 average of nine possible interpretations per cross-peak.
3 methyl groups, of which 612 contribute NOESY cross peaks.
4 ion can be monitored by the movements of the cross peaks.
5 n-water NOEs from alternate exchange-relayed cross peaks.
6 tifies the sequence positions of 1H-15N HSQC cross-peaks.
7 rom inspection of intraresidual (H1',H6) NOE cross-peaks.
8 d a significant number of intermolecular NOE cross-peaks.
9 ngly intense intra- and intermolecular NOESY cross-peaks.
10 221 in PTP1B) to alanine abolished all three cross-peaks.
11 encoded in the signs and intensities of the cross-peaks.
12 y complex perturbs most of the (1)H(N)-(15)N cross-peaks.
13 differences in the number of detectable NMR cross-peaks.
14 formational exchange broadening of all F5 NH cross-peaks.
15 sed dramatic perturbation of most of the NMR cross-peaks.
16 ) have less than half the expected number of cross-peaks.
17 unusual intensities observed for DNA-DNA NOE cross-peaks.
18 R shifts is obtained from the development of cross-peaks.
19 well as interior cellulose-surface cellulose cross-peaks.
22 istinguished by examining the time-dependent cross-peak amplitudes for specific excitation and detect
23 , which are subsequently used to reconstruct cross-peak amplitudes of a pseudo-3D data set as a funct
25 by fitting the mixing time dependence of the cross-peak and diagonal-peak signals to a magnetization
28 ed from quantitative simulations of 2QF-COSY cross-peaks and from persistent inconsistencies in exper
31 (MQ) spin coherences, which lead to spurious cross-peaks and phase-twisted lines in the 2D (15)N-(13)
32 ined by quantitative simulations of DQF-COSY cross-peaks and used to determine sugar pucker populatio
34 f 1H and 15N chemical shifts, sequential NOE cross-peaks, and S2 values of the backbone atoms, and th
35 r the spatial contacts that give rise to the cross peaks are artifacts of sample preparation, we now
41 t example of the observation and analysis of cross-peaks arising from chemical exchange processes inv
42 ed as a function of temperature, showed that cross-peaks arising from the alpha-helical backbone and
43 nterference effects between the diagonal and cross-peaks arising from the sheets, combined with diago
44 o DNA we were able to directly observe three cross-peaks, arising from lysine NH3 groups, with 15N ch
45 complex, were used to classify the exchange cross peaks as follows: (A) a direct NOE with a water pr
46 onventional analysis would have assigned the cross-peaks as being indicative of a chemical exchange p
47 s identified intermolecular pectin-cellulose cross-peaks as well as interior cellulose-surface cellul
49 lution were obtained, exhibiting (19)F-(19)F cross peaks associated with fluorine atoms as far as ~10
51 illatory quantum energy transport but also a cross-peak asymmetry not previously explained by theory.
52 r presence of 50 mm sodium chloride showed a cross peak at 10.25 ppm on the 1H axis and 129 ppm on th
53 tion spectra reveal seven His37 Calpha-Cbeta cross peaks at different pH, some of which are unique to
56 g of selected residues show relatively sharp cross-peaks at chemical shifts that are consistent with
57 PTP1B/Cinn-GEE complex showed three distinct cross-peaks at delta 7.6-7.8 ((1)H) and 130-137 ((13)C).
58 bonded amide(1)H and (15)N spins but also a cross peak between the (1)H chemical shift from bulk wat
61 ncy CN stretching mode contributes to strong cross peaks between CN groups in two different chemical
62 ponding (1)H 2D NOESY NMR spectra display no cross peaks between HPTS and AOT consistent with the HPT
65 x of CoA, chloramphenicol and enzyme, 71 NOE cross peaks between protons of coenzyme A and a further
66 mixed, so that only interresidue (13)C-(13)C cross peaks between two differently labeled proteins rep
68 (1)H NMR and ROESY spectra results showed a cross-peak between H-3 proton of beta-cyclodextrin and t
70 ily, the emergence in 2D and 3D spectra of a cross-peak between reactant and product reveals the cis-
71 r characterized by (19)F NMR and show an NOE cross-peak between residues that are located on differen
72 two could be directly determined from NOESY cross-peaks between CH beta protons of the corresponding
75 ween protons of coenzyme A and a further ten cross-peaks between protons of coenzyme A and chloramphe
77 ase-pairs, no nuclear Overhauser enhancement cross-peaks between the cobalt ligand and neighboring RN
79 navalin A, ribonuclease A, and lysozyme show cross-peaks between the IR-active transitions that are c
80 ptide and U46619 using the comparison of the cross-peaks between the NOESY spectra of U46619 with the
81 by intermolecular nuclear Overhauser effect cross-peaks between the peptide and short chain dioctano
83 and ion stretches and probing the associated cross-peaks between them, we are afforded a comprehensiv
86 most no detectable chemical shift changes of cross-peaks, but some general increase in line width.
87 combination of amide I' and II' diagonal and cross peaks can effectively distinguish between secondar
88 ere we report that chemical exchange-induced cross-peaks can arise in even the simplest two-dimension
96 uted for Cys 187 and 188 shows only two main cross-peaks, corresponding to Cys 123 and 136 from the C
97 were used to confirm the assignment of NOESY cross-peaks critical in defining the global fold of the
99 (MAUS), leveraging Nuclear Overhauser Effect cross-peak data, peak residue type classification and a
100 termolecular nuclear Overhauser effect (NOE) cross-peaks define a specific complex in which the Co(NH
101 pectroscopy (HYSCORE) spectra exhibit strong cross-peaks demonstrating strong isotropic coupling of t
102 s in multilamellar lipid vesicles, where the cross-peak development arises from the exchange of the n
106 assignments because of the loss of key TOCSY cross-peaks due to the line broadening from a dynamic he
107 p synthase with 1-15N-L-Trp showed a similar cross peak either in the presence or absence of disodium
108 to protein, oligosaccharide and nucleic acid cross-peak enhancements of ~200-1000% per scan, in measu
109 ysis, we obtained signals with well resolved cross-peak features attributed to the couplings within a
110 alpha-helical FP but weak or no (31)P-water cross peak for neutral membranes containing the beta-she
111 H correlation spectra show clear (31)P-water cross peaks for anionic membranes containing the alpha-h
112 Analysis of the buildup rate of the exchange cross peaks for several base-paired imino protons in the
113 hemical shift and the appearance of multiple cross-peaks for certain residues, suggesting that the do
114 shift-pH titration curves are obtained from cross-peaks for reporter protons in BASHD-TOCSY spectra
118 beta-sheet of ubiquitin through the loss of cross peaks formed between transitions arising from delo
120 otropic chemical shift data and interhelical cross peaks from magic angle spinning solid-state NMR of
123 way, to N-betaGRP results in the loss of NMR cross-peaks from the backbone (15)N-(1)H groups of the p
125 s is evident from the significant direct NOE cross-peaks from the protons of Co(NH3)6(3+) to GH8, GH1
127 e narrowed spectra of acyl-proline-NH(2) and cross peaks implying the coupling between its amide-I mo
128 es in 1D (15)N spectra as well as additional cross peaks in 2D (13)C-(13)C and (13)C-(15)N spectra.
130 and strong water-AFP III and water-ubiquitin cross peaks in frozen solution using relaxation filtered
132 cific assignments of considerably overlapped cross peaks in the 1H-NMR spectrum of a DNA trinucleotid
133 dependent amplitudes and energy positions of cross peaks in the 2.21/1.85 eV (excitation/detection) r
135 We observe multiple absorption bands but no cross peaks in the 2D IR spectra, which indicates that t
136 are directly measured through the growth of cross peaks in the 2D-IR spectra of CO bound to the heme
137 ns in the line widths and chemical shifts of cross peaks in the HSQC spectrum of CD2d1 during titrati
139 the holo-form, Phe17 shows an extra exchange cross-peak in addition to those exchange cross-peaks obs
140 ven histidine residues gave rise to a single cross-peak in the HMQC spectra, and these were assigned
141 with the observation of strong peptide-water cross-peaks in (1)H spin diffusion spectra, these result
145 se of polarized pulse sequences to elucidate cross-peaks in 2D spectra has been demonstrated in the I
146 e absence of glycerol and produced dispersed cross-peaks in a (1)H-(15)N heteronuclear single quantum
147 easured the intensity buildup of (13)C-(13)C cross-peaks in a series of 2D (13)C correlation spectra
149 The method assists in the identification of cross-peaks in crowded regions of ROESY spectra by movin
150 e of long-range HSQMBC to address inadequate cross-peaks in HMBC that result from the highly dense qu
152 constraints based on the analysis of absent cross-peaks in solid-state NMR correlation experiments.
153 sults in the selective broadening of certain cross-peaks in the 15N-1H heteronuclear single quantum c
155 roborated by DQF-COSY H2/N1H and ROE N1H/N6H cross-peaks in the 2D NMR spectra of Rh2(DTolF)2{d(ApA)}
157 TolF)2{d(ApA)} is indicated by the H8/H8 NOE cross-peaks in the 2D ROESY NMR spectrum, whereas the fo
160 terconvert slowly enough to exhibit separate cross-peaks in the amide region of homonuclear and heter
162 here the weak coupling pairs are revealed as cross-peaks in the indirect dimension separated by the i
165 ve analysis also identifies vulnerable CH(2) cross-peaks in the standard ME-HSQC that coincide with C
166 ocket, 16 residues had weak or no detectable cross-peaks in the two-dimensional 1H-15N HSQC spectrum
168 emonstrate how the structural sensitivity of cross-peaks in two-dimensional correlation plots of chir
170 (2)H distance measurements and (1)H-(1)H NOE cross peaks indicate that the adamantane moiety of the d
171 oton chemical shift and the intensity of the cross-peak indicate a very short hydrogen bond to the ca
173 lation intensity between the two alpha-helix cross peaks indicated that the more hydrophobic helix fr
174 uronan is extracted retains cellulose-pectin cross peaks, indicating that the cellulose-pectin contac
175 ite, shows two sets of side-chain (15)N-(1)H cross-peaks, indicating conformational flexibility.
176 han for interior cellulose-surface cellulose cross-peaks, indicating that pectins come into direct co
177 ion of the nitrogen-amide proton correlation cross-peaks indicative of a pure, uniformly labeled mole
180 x shows only one set of NMR signals, and the cross-peak intensities are rather uniform, suggesting th
181 oduces complex two-dimensional spectra whose cross-peak intensities are related to correlations in th
182 ensities, and (ii) they significantly reduce cross-peak intensities for strongly J-coupled (13)C site
183 om total relaxation matrix analysis of NOESY cross-peak intensities in restrained molecular dynamics
186 Distance restraints were calculated from NOE cross-peak intensities via a complete relaxation matrix
189 tion and prohibit the extraction of reliable cross-peak intensities, and (ii) they significantly redu
190 n and subsequent analysis of two-dimensional cross-peak intensities, the chemical identity and mass c
191 uclear Overhauser effect (NOE) spectroscopic cross-peak intensities, yielding accurate distance restr
194 ar NMR showed a steep decrease in (1)H-(15)N cross-peak intensity for 8 residues in the isolated C-te
195 e conventional use of long mixing time NOESY cross-peak intensity, backbone angles, and hydrogenbondi
196 by significant and selective increased NOESY cross-peak intensity, increase in steric Fe-CN tilt refl
200 ependence of the intensity of these spectral cross-peaks is consistent with an active site tyrosine w
201 to analyze the relaxation data of the type A cross peaks, it was found that the water molecules had s
202 ollapse of the scalar multiplet structure of cross-peaks leads to a sensitivity gain of about 40-50%
203 romosome 16A1-B1 (DOXNPH locus) in all three crosses [peak logarithm of odds (lod) score of 92.7, P =
204 on, such that robust monoexponential fits to cross-peaks may be used to determine the diffusion coeff
205 d time scale, and misinterpretation of these cross-peaks may lead to erroneous conclusions should the
207 tios for the C(epsilon 1)-H and C(delta 2)-H cross-peaks measured with a constant time HSQC experimen
208 rom the C-loop condense into two predominant cross-peaks not observed in the spectrum from the apo pr
210 design principles as the HISQC, all the NH3 cross-peaks observed in the HISQC spectrum could be assi
215 anol (TFE) shows that the individual residue cross peaks of IA(3) become more dispersed in the presen
216 ve attenuation in the 1H-15N HSQC spectra of cross peaks of residues at the end of helix 3 (Ser-58, L
219 s challenge can be addressed by using fitted cross-peaks of a reference 2D HSQC experiment as footpri
221 , which made possible the measurement of NOE cross-peaks of relatively rapidly exchanging amide proto
223 -exchange spectroscopy between corresponding cross-peaks of the magnetically non-equivalent subunits
226 s, and in each case we see the appearance of cross-peaks on the timescale of a few picoseconds, signa
229 and presence of glucose, reveal significant cross-peak overlap and heterogeneous peak intensities th
230 c C terminus, is highly flexible, exhibiting cross-peak patterns and transverse relaxation rates that
238 3 sequential and medium range intrachain NOE cross peaks per chain, characteristic of alpha-helices e
240 We report the dependence of the diagonal-to-cross-peak ratio on concentration, light intensity, and
241 f sufficiently high quality that many of the cross peaks, recorded previously from malignant cell mod
242 rotein structure indicates that the observed cross-peak reduction is well correlated with a high perc
245 dard ME-HSQC that coincide with CH(3) and CH cross-peaks, resulting in the loss of critical structura
246 Long-range nuclear Overhauser effect (NOE) cross-peaks showed the two helices to be in near proximi
248 the HSQC-CLIP-COSY pulse sequence that edit cross-peak signs so that direct HSQC responses can be di
250 we develop 2D electronic spectroscopy using cross-peak-specific pulse polarization conditions in an
251 hibit signs of differential line broadening, cross-peak splitting and chemical shift heterogeneity th
252 N line shapes and higher intensities for NH3 cross-peaks than either HSQC or heteronuclear multiple q
253 re only modestly longer for cellulose-pectin cross-peaks than for interior cellulose-surface cellulos
254 lanine produced perturbations of the His-258 cross-peak that were similar to those detected in the E3
257 rn delta-proton magnetic anisotropy, and NOE cross-peaks that establish all compounds but 1c and 1g t
258 ion, we are able to isolate sharp difference cross-peaks that report on local changes in vibrational
261 nce, as demonstrated with the observation of cross-peaks to resonances at the frequency of the water
262 multiplets to singlets in the F1 dimension, cross-peaks to the anomeric protons of the two iduronic
263 eous to the excitation, including pronounced cross-peaks to the bend vibration and a continuum of ind
264 d from the sign and magnitude of NOE and ROE cross-peaks to water identified in 2D NOESY and ROESY ex
267 des a large number of accurate values of NOE cross peak volumes in a decoupled HMQC-NOESY spectrum.
268 significant difference (P < .05) between the cross peak volumes measured for healthy subjects and tho
269 tial Halpha-HN to intraresidue HN-Halpha NOE cross-peak volumes support a predominantly extended conf
270 th crystal structures and the fact that this cross-peak was absent in the heteronuclear correlation s
271 om time-dependent shifts of the stretch-bend cross peak, we determined a lower limit on the lifetime
273 sidue nuclear Overhauser effect spectroscopy cross peaks were observed at 30 degrees C and a 200 ms m
275 proximately 90% of the 949 unambiguous NOESY cross-peaks were assigned automatically with simultaneou
276 Mb data sets collected at various pH values, cross-peaks were assigned to the imidazole rings and the
279 mellar suspensions of MeDOPE, positive NOESY cross-peaks were observed between the downfield-shifted
285 tly (15)N-labeled in P. pastoris, and proton cross-peaks were well dispersed in nuclear Overhauser ef
286 n intensity and disappearance of 1H-15N HSQC cross-peaks, were observed with the addition of either s
287 sensitivity, evidenced by 50-100% additional cross peaks, when compared to alternative processing sch
288 of NP2-ImH mutants exhibit chemical exchange cross peaks, whereas WT NP2-ImH shows no chemical exchan
289 in PTP1B) into alanine had no effect on the cross-peaks, whereas mutation of a conserved active-site
290 agonal allows the accurate identification of cross-peaks which are otherwise obscured by the strong a
291 ugs permitted the assignment of drug-protein cross peaks, which indicate that amantadine and rimantad
292 s separated by one or two bonds (2.5 A) show cross peaks, which therefore identify reference intracha
293 dy revealed the presence of interknuckle NOE cross-peaks, which were interpreted in terms of a more c
294 of free [15N]PGH shows a single 1H-15N HMQC cross peak with delta (1H) = 10.3 ppm and delta (15N) =
295 well as arginines, showed intermolecular NOE cross-peaks with D8PG, providing direct evidence for the
296 The sugar H2' and H2' ' of dC(5) lacked NOE cross-peaks with H8 of dA(6) but showed weak interaction
297 with Phe2, Phe47, and Phe62 showing exchange cross-peaks with minor conformation in (19)F-(19)F nucle
299 y 15N-labeled protein show two well resolved cross-peaks with weak couplings of approximately 0.3-0.4
300 eral unambiguously identified long-range NOE cross-peaks within the loop region and between TM2 and T