Determination of Protein–Ligand Binding Modes Using Complexation-Induced Changes in1H NMR Chemical Shift

Marina Cioffi; Christopher A. Hunter; Martin J. Packer; Andrea Spitaleri

doi:10.1021/jm701194r

Determination of Protein–Ligand Binding Modes Using Complexation-Induced Changes in1H NMR Chemical Shift

Journal of Medicinal Chemistry ◽

10.1021/jm701194r ◽

2008 ◽

Vol 51 (8) ◽

pp. 2512-2517 ◽

Cited By ~ 28

Author(s):

Marina Cioffi ◽

Christopher A. Hunter ◽

Martin J. Packer ◽

Andrea Spitaleri

Keyword(s):

Chemical Shift ◽

Ligand Binding ◽

Binding Modes ◽

Nmr Chemical Shift ◽

Induced Changes

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Monitoring the Ligand Binding Mode by Proton NMR Chemical Shift Differences

ChemMedChem ◽

10.1002/cmdc.200600175 ◽

2006 ◽

Vol 1 (11) ◽

pp. 1197-1199 ◽

Cited By ~ 1

Author(s):

Srisunder Subramaniam ◽

Stephen L. Briggs ◽

Allen D. Kline

Keyword(s):

Chemical Shift ◽

Ligand Binding ◽

Proton Nmr ◽

Binding Mode ◽

Nmr Chemical Shift

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INPHARMA‐Based Determination of Ligand Binding Modes at α 1 ‐Adrenergic Receptors Explains the Molecular Basis of Subtype Selectivity

Chemistry - A European Journal ◽

10.1002/chem.202000642 ◽

2020 ◽

Vol 26 (51) ◽

pp. 11796-11805

Author(s):

Tasneem M. Vaid ◽

David K. Chalmers ◽

Daniel J. Scott ◽

Paul R. Gooley

Keyword(s):

Ligand Binding ◽

Adrenergic Receptors ◽

Molecular Basis ◽

Binding Modes ◽

Subtype Selectivity

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Stability constants: comparative study of fitting methods. Determination of second-order complexation constants by23Na and7Li NMR chemical shift titration

Magnetic Resonance in Chemistry ◽

10.1002/mrc.1787 ◽

2006 ◽

Vol 44 (3) ◽

pp. 220-229 ◽

Cited By ~ 11

Author(s):

Marilyn C. Masiker ◽

Charles L. Mayne ◽

Edward M. Eyring

Keyword(s):

Chemical Shift ◽

Comparative Study ◽

Stability Constants ◽

Second Order ◽

Complexation Constants ◽

Nmr Chemical Shift ◽

Chemical Shift Titration

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Determination of Water Content in Bioethanol Using the 1 H NMR Chemical Shift Change

Bulletin of the Korean Chemical Society ◽

10.1002/bkcs.11692 ◽

2019 ◽

Vol 40 (4) ◽

pp. 313-316

Author(s):

Jeongbin Yoon ◽

Suyeon Yun ◽

Byungjoo Kim ◽

Sangdoo Ahn ◽

Kihwan Choi

Keyword(s):

Chemical Shift ◽

Water Content ◽

Chemical Shift Change ◽

Nmr Chemical Shift ◽

H Nmr ◽

Shift Change

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NMR chemical shift reagents in structural determination of lipid derivatives: II. Methyl petroselinate and methyl oleate

Journal of the American Oil Chemists Society ◽

10.1007/bf02582591 ◽

1972 ◽

Vol 49 (4) ◽

pp. 267-273 ◽

Cited By ~ 20

Author(s):

John P. Wineburg ◽

Daniel Swern

Keyword(s):

Chemical Shift ◽

Methyl Oleate ◽

Structural Determination ◽

Nmr Chemical Shift ◽

Shift Reagents

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Determination of the mutual orientation of the 15N and 13C NMR chemical shift tensors of 13-15N double labeled model peptides for silk fibroin from the dipolar-coupled powder patterns

Journal of Molecular Structure ◽

10.1016/s0022-2860(98)00291-9 ◽

1998 ◽

Vol 446 (3) ◽

pp. 179-190 ◽

Cited By ~ 4

Author(s):

Tetsuo Asakura ◽

Yasunobu Yamazaki ◽

Koo Wey Seng ◽

Makoto Demura

Keyword(s):

Chemical Shift ◽

Silk Fibroin ◽

13C Nmr ◽

Mutual Orientation ◽

Nmr Chemical Shift ◽

Chemical Shift Tensors ◽

Model Peptides

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Independent determination of association constant and shift of the pure complex from NMR chemical shift data by a graphical method

Journal of Magnetic Resonance (1969) ◽

10.1016/0022-2364(83)90016-1 ◽

1983 ◽

Vol 51 (2) ◽

pp. 318-322 ◽

Cited By ~ 1

Author(s):

B.K Seal ◽

A.K Mukherjee ◽

D.C Mukherjee ◽

P.G Farrell ◽

J.V Westwood

Keyword(s):

Chemical Shift ◽

Association Constant ◽

Graphical Method ◽

Nmr Chemical Shift ◽

Independent Determination ◽

Chemical Shift Data ◽

Shift Data ◽

Pure Complex

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Determination of the structure of 3-acylmethylene-2,3-dihydrofurans with the aid of 2D NOESY Spectra:1H and13C NMR chemical shift assignment

Magnetic Resonance in Chemistry ◽

10.1002/(sici)1097-458x(199908)37:8<605::aid-mrc508>3.0.co;2-f ◽

1999 ◽

Vol 37 (8) ◽

pp. 605-607 ◽

Cited By ~ 2

Author(s):

J. G. Sośnicki ◽

Z. Wichert-Tur

Keyword(s):

Chemical Shift ◽

Chemical Shift Assignment ◽

Nmr Chemical Shift ◽

1H And13c Nmr ◽

2D Noesy ◽

Noesy Spectra ◽

Shift Assignment

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Determination of theZ1H NMR chemical shift substituent parameters for the sulfinyl chloride and sulfinate ester functionalities

Journal of Sulfur Chemistry ◽

10.1080/17415990410001662383 ◽

2004 ◽

Vol 25 (1) ◽

pp. 29-37 ◽

Cited By ~ 1

Author(s):

Jennifer S. O'Donnell ◽

Robert J. Faragher ◽

John M. Motto ◽

Adrian L. Schwan

Keyword(s):

Chemical Shift ◽

Nmr Chemical Shift

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NMR Chemical Shift Methods for Binding Constant Determination of an Organic Anion andα-Cyclodextrin

Bulletin of the Chemical Society of Japan ◽

10.1246/bcsj.75.719 ◽

2002 ◽

Vol 75 (4) ◽

pp. 719-723 ◽

Cited By ~ 10

Author(s):

Noriaki Funasaki ◽

Seiji Ishikawa ◽

Saburo Neya

Keyword(s):

Chemical Shift ◽

Binding Constant ◽

Organic Anion ◽

Nmr Chemical Shift ◽

Constant Determination

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