Automated structure determination of proteins by NMR spectroscopy

被引：86

作者：

Gronwald, W ^{[1
]}

Kalbitzer, HR ^{[1
]}

机构：

[1] Univ Regensburg, Inst Biophys & Phys Biochem, D-93040 Regensburg, Germany

来源：

PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY | 2004年 / 44卷 / 1-2期

关键词：

NMR; automation; spectra assignment; spectra simulation; structure determination; molecule centered;

D O I：

10.1016/j.pnmrs.2003.12.002

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

The use of nuclear magnetic resonance (NMR) spectroscopy for automated structure determination of proteins was discussed. NMR spectroscopy enables to perform in solution under nearly physiological conditions and dynamic properties can be studied in detail. It was suggested that computer program permits intervention at any step in the automated analysis to allow structural and spectroscopic information to be included from other sources. Various aspects of the evaluation process should also be supervised using the computer program.

引用

页码：33 / 96

页数：64

共 373 条

[1]

*ACC INC, 2003, INSIGHLL PROGR

[2]

*ACCELRYS INC, 2003, FELIX PROGR

[3] REMOVAL OF DISPERSIVE BASE-LINE DISTORTIONS CAUSED BY STRONG WATER SIGNALS [J].

ADLER, M ;

WAGNER, G .

JOURNAL OF MAGNETIC RESONANCE, 1991, 91 (02) :450-454

[4]

ALBRECHT M, 2002, SILICO BIOL, V2, P1

[5] Structure of peptides and polypeptides in the solid state as elucidated by NMR chemical shift [J].

Ando, I ;

Kameda, T ;

Asakawa, N ;

Kuroki, S ;

Kurosu, H .

JOURNAL OF MOLECULAR STRUCTURE, 1998, 441 (2-3) :213-230

[6] Metropolis Monte Carlo implementation of Bayesian time-domain parameter estimation: Application to coupling constant estimation from antiphase multiplets [J].

Andrec, M ;

Prestegard, JH .

JOURNAL OF MAGNETIC RESONANCE, 1998, 130 (02) :217-232

[7] Protein sequential resonance assignments by combinatorial enumeration using 13Cα chemical shifts and their (i, i-1) sequential connectivities [J].

Andrec, M ;

Levy, RM .

JOURNAL OF BIOMOLECULAR NMR, 2002, 23 (04) :263-270

[8]

Andrec Michael, 2002, Journal of Structural and Functional Genomics, V2, P103, DOI 10.1023/A:1020435630054

[9]

[Anonymous], 2018, Protein nmr spectroscopy: principles and practice

[10] Water peak suppression: Time-frequency vs time-scale approach [J].

Antoine, JP ;

Coron, A ;

Dereppe, JM .

JOURNAL OF MAGNETIC RESONANCE, 2000, 144 (02) :189-194

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