• 제목/요약/키워드: Nuclear magnetic resonance (Nmr)

검색결과 543건 처리시간 0.024초

Self-Diffusion of Hydrophobically End-Capped Polyethylene Oxide Urethane Resin by Using Pulsed-Gradient Spin Echo NMR Spetroscopy

  • Park, Jinwoo;Daewon Sohn;Lee, Youngil;Chaejoon Cheong
    • Macromolecular Research
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    • 제11권6호
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    • pp.444-450
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    • 2003
  • Hydrophobically End-capped polyethylene oxide Urethane Resin(HEUR)-associating polymers, HEUR 35(8), HEUR 35(12), and HEUR 35(18), comprise a polyethylene oxide (PEO) having a molecular weight of 35,000 that is end capped with two C$\_$8/H$\_$17/, C$\_$12/H$\_$25/, and C$\_$18/H$\_$37/ alkyl chains, respectively. These associating polymers were synthesized by condensation reactions with polyethylene oxides and alkyl isocyanates. The self-diffusion coefficients of HEUR-associating polymers were measured in aqueous solution by pulsed-gradient spin-echo (PGSE) nuclear magnetic resonance (NMR) spectroscopy. All polymers underwent a decrease in their mean diffusion coefficients as the concentration was increased. However, the dispersion of the diffusion coefficients, ${\beta}$, about the mean fluctuated with changes in concentration. The large dispersion at low concentrations of HEUR 35(8) and HEUR 35(12) is related to the interaction between hydrophobic end groups, and the large dispersion at high concentrations of HEUR 35(18) is correlated with transient network formation. These results are valuable for predicting the associating mechanism of the large aggregates before and after their critical micelle concentration.

Backbone assignment of HMGB1 A-box and molecular interaction with Hoxc9DBD studied by paramagnetic probe

  • Choi, Ji Woong;Park, Sung Jean
    • 한국자기공명학회논문지
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    • 제25권2호
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    • pp.17-23
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    • 2021
  • High mobility group protein B1 (HMGB1) is a highly conserved, non-histone, chromatin associated nuclear protein encoded by HMGB1 gene. HMGB1 proteins may be general co-factors in Hox-mediated transcriptional activation that facilitate the access of Hox proteins to specific DNA targets. It is unclear that the exact binding interface of Hoxc9DBD and HMGB1. To identify the interface and binding affinity of Hoxc9DBD and HMGB1 A-box, the paramagnetic probe, MTSL was used in NMR titration experiment. It is attached to the N-terminal end of HMGB1 A-box by reaction with thiol groups. The backbone assignment of HMGB1 A-box was achieved with 3D NMR techinques. The 15N-labeled HMGB1 A-box was titrated with MTSL-labeled Hoxc9DBD respectively. Based on the chemical shift changes we can identify the interacting residues and further map out the binding sites on the protein structure. The NMR titration result showed that the binding interface of HMGB1 A-box is around loop-1 between helix-1 and helix-2. In addition, the additional contacts were found in N- and C-terminus. The N-terminal arm region of Hoxc9DBD is the major binding region and the loop between helix1 and helix2 is the minor binding region.

In Situ NMR 진단용 원통형 직접 메탄올 연료전지 (Tubular Type Direct Methanol Fuel Cell for in situ NMR Diagnosis)

  • 조한익;엄명섭;한기성;한옥희;하흥용;김수길
    • 전기화학회지
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    • 제12권4호
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    • pp.329-334
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    • 2009
  • 본 연구는 연료전지 운전시 전극 촉매 및 전해질막 내에서 발생하는 연료 및 산화제의 산화/환원 반응 메커니즘, 이동현상, 구성품 열화현상 등을 핵자기 공명 (NMR, Nuclear Magnetic Resonance)을 이용하여 연료전지의 분해나 시료 채취 없이 제자리 (in situ) 분석할 수 있는 진단장치용 연료전지 개발에 관한 것이다. NMR에 사용되는 연료전지는 특수하게 제작된 TCD (Toroid Cavity Detector) 탐침 내부에서 작동하여야 하며, TCD 탐침이 가지는 기하학적 제한 요소들로 인해 일반적인 평판형 연료전지와 달리 원통형으로 제작된다. 이로 인해 반응물의 공급이나 생성물의 제거가 어려우며 누수 현상 및 불균일한 압력 분배가 발생하여 성능이 낮다. 따라서, in situ NMR 분석용 연료전지가 가지는 구조상의 특징인 원통형에 적합한 유로를 설계하고 제작하여 물질 전달 특성을 개선해야 할 필요성이 있다. 본 연구에서는 NMR 장비 내의 자기장에 영향을 미치지 않는 비자성 물질을 이용해 원 통형 공기극 유로를 개발하여, 산소의 공급 및 반응물의 제거를 원활하게 하였다. 또한, 체결 압력을막-전극 접합체에 균일하게 분배하여 누수 및 누액을 차단하였다. 이를 통해, 상온에서 약 $36mW/cm^2$의 우수한 성능을 나타내는 in situ NMR 진단용 직접 메탄올연료전지 시스템을 개발하였다.

핵자기공명(NMR) 응용을 위한 고자장 초전도 마그네트의 최적화 설계 (High Field Superconducting Magnet Optimal Design for Nuclear Magnetic Resonance (NMR) Applications)

  • 고락길;조영식;권영길;진홍범;배준한;심기덕;류강식
    • 한국초전도저온공학회:학술대회논문집
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    • 한국초전도저온공학회 2000년도 KIASC Conference 2000 / 2000년도 학술대회 논문집
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    • pp.150-153
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    • 2000
  • NMR researches are required high field and high homogeneous super-conducting magnet. Thus superconducting magnets for NMR applications are designed with minimization of coil winding volume satisfied constraints such as field strength, field homogeneity, etc. In this paper, we are discussed optimal design of high field super-conducting magnet for NMR applications. For a design example, we designed unshielded superconducting magnet for 600MHz NMR spectrometer with 100mm room temperature bore size and obtained 14.1011[T] field strength and 1.33 ppm field homogeneity.

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1H-NMR 스펙트럼의 다변량통계분석을 통한 넙치(Paralichthys olivaceus)의 백신 반응의 지표물질 분석 (Multivariate Analysis on 1H-NMR Spectroscopy of Olive Flounder Paralichthys olivaceus Serum)

  • 조지영
    • 한국수산과학회지
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    • 제45권4호
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    • pp.367-371
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    • 2012
  • To investigate the relationship between metabolic changes in $^1H$-nuclear magnetic resonance (NMR) spectra and fish vaccination, serum was collected from olive flounders treated with a formalin-killed Edwardsiella tarda vaccine and used for $^1H$-NMR metabolite profiling. Principal component analysis and partial least squares were applied to the $^1H$-NMR profile to reduce its complexity and establish class-related clusters. Relative lipid regions were distinguished in vaccinated and non-vaccinated serum. Then, the lipids were extracted from the serum and analyzed. Triolein was identified.

NMR을 이용한 음이온 및 비이온세제의 혼합물로부터 ABS의 정량 (Quantitative Determination of ABS from Mixture of Anionic and Nonionic Detergents by NMR)

  • 최광훈;권순자
    • 대한화학회지
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    • 제27권6호
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    • pp.419-423
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    • 1983
  • 음이온세제와 비이온세제의 혼합물에서 alkylbenzene sulfonate 계통의 음이온 세기가 NMR법에 의해서 정량되었다. 음이온세제와 비이온세제의 혼합물에 대한 NMR 스펙트럼에서, 벤젠 그룹은 6.5∼8ppm에서 중첩된 피크를 보여주나 sampling 후의 벤젠 그룹은 7∼8ppm에서 두개의 doublet을 보여준다. 검량선은 음이온세제의 벤젠그룹과 초산의 메칠그룹의 상대적인 면적비에 의해서 작성되었다. (초산은 내부표준물로 사용되었다.)

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Metabolic Discrimination of Safflower Petals of Various Origins Using 1H NMR Spectroscopy and Multivariate Statistical Analysis

  • Whang, Wan-Kyun;Lee, Min-Won;Choi, Hyung-Kyoon
    • Bulletin of the Korean Chemical Society
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    • 제28권4호
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    • pp.557-560
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    • 2007
  • The metabolic discrimination of safflowers from various geographical origins was performed using 1H nuclear magnetic resonance (NMR) spectroscopy followed by principal components analysis. With a combination of these techniques, safflower samples from different origins could be discriminated using the first two principal components (PC) of the 1H NMR spectra of the 50% methanol fractions. PC1 and PC2 accounted cumulatively for 91.3% of the variation in all variables. The major peaks in the 1H NMR spectra that contributed to the discrimination were assigned to fatty acid (terminal CH3), lactic acid, acetic acid, choline derivatives, glycine, and safflower yellow derivatives. In this study, we suggest that various types of safflower can be discriminated using PCA and 1H NMR spectra.

1H, 15N, and 13C Resonance Assignments of the Anti-CRISPR AcrIIA4 from Listeria monocytogenes Prophages

  • Kim, Iktae;Kim, Nak-Kyoon;Suh, Jeong-Yong
    • 한국자기공명학회논문지
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    • 제22권3호
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    • pp.71-75
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    • 2018
  • The CRISPR-Cas system is the adaptive immune system in bacteria and archaea against invading phages or foreign plasmids. In the type II CRISPR-Cas system, an endonuclease Cas9 cleaves DNA targets of phages as directed by guide RNA comprising crRNA and tracrRNA. To avoid targeting and destruction by Cas9, phages employ anti-CRISPR (Acr) proteins that act against host bacterial immunity by inactivating the CRISPR-Cas system. Here we report the backbone $^1H$, $^{15}N$, and $^{13}C$ resonance assignments of AcrIIA4 that inhibits endonuclease activity of type II-A Listeria monocytogenes Cas9 and also Streptococcus pyogenesis Cas9 using triple resonance nuclear magnetic resonance spectroscopy. The secondary structures of AcrIIA4 predicted by the backbone chemical shifts show an ${\alpha}{\beta}{\beta}{\beta}{\alpha}{\alpha}$ fold, which is used to determine the solution structure.

Field gradient calculation of HTS double-pancake coils considering the slanted turns and the splice

  • Baek, Geonwoo;Kim, Jinsub;Lee, Woo Seung;Song, Seunghyun;Lee, Onyou;Kang, Hyoungku;Ko, Tae Kuk
    • 한국초전도ㆍ저온공학회논문지
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    • 제19권1호
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    • pp.51-55
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    • 2017
  • To obtain Nuclear Magnetic Resonance (NMR) measurement of membrane protein, an NMR magnet is required to generate high intensity, homogeneity, and stability of field. A High-Temperature Superconducting (HTS) magnet is a promising alternative to a conventional Low-Temperature Superconducting (LTS) NMR magnet for high field, current density, and stability margin. Conventionally, an HTS coil has been wound by several winding techniques such as Single-Pancake (SP), Double-Pancake (DP), and layer-wound. The DP winding technique has been frequently used for a large magnet because long HTS wire is generally difficult to manufacture, and maintenance of magnet is convenient. However, magnetic field generated by the slanted turns and the splice leads to field inhomogeneity in Diameter of Spherical Volume (DSV). The field inhomogeneity degrades performance of NMR spectrometer and thus effect of the slanted turns and the splice should be analyzed. In this paper, field gradient of HTS double-pancake coils considering the slanted turns and the splice was calculated using Biot-Savart law and numerical integration. The calculation results showed that magnetic field produced by the slanted turns and the splice caused significant inhomogeneity of field.

A Solid-State NMR Study of Water in Poly(vinyl butyral) by Magic Angle Spinning

  • Jeong, Soon-Yong;Han, Oc-Hee
    • Bulletin of the Korean Chemical Society
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    • 제28권4호
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    • pp.662-666
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    • 2007
  • Poly(vinyl butyral) (PVB) with different wt% water was studied gravimetrically as well as with 1H magic angle spinning (MAS) nuclear magnetic resonance (NMR). The composition of PVB samples changes during MAS NMR because of the centrifugal force. As MAS time progresses, initially free water was removed fast but bound water also was gradually depleted. More water was diminished at faster spinning speeds, longer spinning time, higher temperatures, and higher initial water contents. As water in PVB was reduced, the chemical shifts and line widths of different types of water and also those of PVB changed. Our results demonstrate that 1H MAS NMR carried out at 10 kHz in less than about 5 minutes is a convenient and sensitive technique to measure: (a) the content variations of different types of water in polymers, (b) the degree of the interaction of water and polymer, and (c) the molecular dynamics of the polymer. Our study can be extended to different soft polymers with other small molecules than water in them.