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1
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0029836953
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Discovering high-affinity ligands for proteins - SAR by NMR
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Shuker, S. B.; Hajduk, P. J.; Meadows, R. P.; Fesik, S. W. Discovering High-Affinity Ligands for Proteins - SAR by NMR. Science 1996, 274, 1531-1534.
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(1996)
Science
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Shuker, S.B.1
Hajduk, P.J.2
Meadows, R.P.3
Fesik, S.W.4
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2
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16944365890
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Discovery of potent nonpeptide inhibitors of stromelysin using SAR by NMR
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Hajduk, P. J.; Sheppard, D. G.; Nettesheim, D. G.; Olejniczak, E. T.; Shuker, S. B.; Meadows, R. P.; Steinman, D. H.; Carrera, G. M., Jr.; Marcotte, P. M.; Severin, J.; Walter, K.; Smith, H.; Gubbins, E.; Simmer, R.; Holzman, T. F.; Morgan, D. W.; Davidsen, S. K.; Summers, J. B.; Fesik, S. W. Discovery of Potent Nonpeptide Inhibitors of Stromelysin Using SAR by NMR. J. Am. Chem. Soc. 1997, 119, 5818-5827.
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(1997)
J. Am. Chem. Soc.
, vol.119
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Hajduk, P.J.1
Sheppard, D.G.2
Nettesheim, D.G.3
Olejniczak, E.T.4
Shuker, S.B.5
Meadows, R.P.6
Steinman, D.H.7
Carrera G.M., Jr.8
Marcotte, P.M.9
Severin, J.10
Walter, K.11
Smith, H.12
Gubbins, E.13
Simmer, R.14
Holzman, T.F.15
Morgan, D.W.16
Davidsen, S.K.17
Summers, J.B.18
Fesik, S.W.19
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3
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9844252882
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NMR-based discovery of lead inhibitors that block DNA binding of the human papillomavirus E2 protein
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Hajduk, P. J.; Dinges, J.; Miknis, G. F.; Merlock, M.; Middleton, T.; Kempf, D. J.; Egan, D. A.; Walter, K. A.; Robins, T. S.; Shuker, S. B.; Holzman, T. F.; Fesik, S. W. NMR-Based Discovery of Lead Inhibitors that Block DNA Binding of the Human Papillomavirus E2 Protein. J. Med. Chem. 1997, 40, 3144-3150.
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(1997)
J. Med. Chem.
, vol.40
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Hajduk, P.J.1
Dinges, J.2
Miknis, G.F.3
Merlock, M.4
Middleton, T.5
Kempf, D.J.6
Egan, D.A.7
Walter, K.A.8
Robins, T.S.9
Shuker, S.B.10
Holzman, T.F.11
Fesik, S.W.12
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4
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48549112442
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A high-resolution NMR probe in which the coil and preamplifier are cooled with liquid helium
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Styles, P.; Soffe, N. F.; Scott, C. A.; Cragg, D. A.; Row, F.; White, D. J.; White, P. C. J. A High-Resolution NMR Probe in Which the Coil and Preamplifier Are Cooled with Liquid Helium. J. Magn. Res. 1984, 60, 397-404.
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(1984)
J. Magn. Res.
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Styles, P.1
Soffe, N.F.2
Scott, C.A.3
Cragg, D.A.4
Row, F.5
White, D.J.6
White, P.C.J.7
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5
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0027908997
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A high-temperature superconducting receiver for nuclear magnetic resonance spectroscopy
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Black, R. D.; Early, T. A.; Roemer, P. B.; Mueller, O. M.; Mogro-Campero, A.; Turner, L. G.; Johnson, G. A. A High-Temperature Superconducting Receiver for Nuclear Magnetic Resonance Spectroscopy. Science 1993, 259, 793.
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(1993)
Science
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Black, R.D.1
Early, T.A.2
Roemer, P.B.3
Mueller, O.M.4
Mogro-Campero, A.5
Turner, L.G.6
Johnson, G.A.7
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6
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0345588012
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Ultra sensitive high-resolution NMR probes
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Poster P122
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Marek, D.; Haeberli, M.; Triebe, R.; Baselgia, L.; Gerfin, T.; Schett, O.; Laukien, F. Ultra Sensitive High-Resolution NMR Probes. ENC97 1997; Poster P122. Marek, D.; Withers, R.; Nast, R.; Haeberli, M.; Baselgia, L.; Gerfin, T.; Calderon, P.; Mehtra, S. Cryogenic High-Resolution NMR Probes. ENC98 1998; Poster 227.
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(1997)
ENC97
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Marek, D.1
Haeberli, M.2
Triebe, R.3
Baselgia, L.4
Gerfin, T.5
Schett, O.6
Laukien, F.7
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7
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0344293692
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Cryogenic high-resolution NMR probes
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Poster 227
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Marek, D.; Haeberli, M.; Triebe, R.; Baselgia, L.; Gerfin, T.; Schett, O.; Laukien, F. Ultra Sensitive High-Resolution NMR Probes. ENC97 1997; Poster P122. Marek, D.; Withers, R.; Nast, R.; Haeberli, M.; Baselgia, L.; Gerfin, T.; Calderon, P.; Mehtra, S. Cryogenic High-Resolution NMR Probes. ENC98 1998; Poster 227.
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(1998)
ENC98
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Marek, D.1
Withers, R.2
Nast, R.3
Haeberli, M.4
Baselgia, L.5
Gerfin, T.6
Calderon, P.7
Mehtra, S.8
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8
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0344293691
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note
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Active compounds can be identified from the active mixture of 100 by deconvolution first as 10 mixtures of 10 compounds each, followed by the testing of the individual compounds in the active mixture of 10. Thus, an additional 20 experiments must be performed to identify the active ligand from a mixture, requiring approximately 5 h of experimental time. These additional experiments should comprise only a small percentage of the time required for screening.
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9
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0345588009
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note
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D < ∼1 μM) dynamics, in which cases the protein resonances can broaden or split into discrete signals for the free and bound states. In these regimes, ligand binding is still readily detected by the extensive perturbations of the protein resonances. However, quantitative determination of the dissociation constants by NMR is more difficult, and only estimates can generally be given.
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10
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0031576702
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One-dimensional relaxation- and diffusion-edited NMR methods for sreening compounds that bind to macromolecules
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Hajduk, P. J.; Olejniczak, E. T.; Fesik, S. W. One-Dimensional Relaxation- and Diffusion-Edited NMR Methods for Sreening Compounds that Bind to Macromolecules. J. Am. Chem. Soc. 1997, 119, 12257-12261.
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(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 12257-12261
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Hajduk, P.J.1
Olejniczak, E.T.2
Fesik, S.W.3
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11
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0001174635
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Diffusion-edited NMR -affinity NMR for direct observation of molecular interactions
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Lin, M.; Shapiro, M. J.; Wareing, J. R. Diffusion-Edited NMR -Affinity NMR for Direct Observation of Molecular Interactions. J. Am. Chem. Soc. 1997, 119, 5249-5250.
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(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 5249-5250
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Lin, M.1
Shapiro, M.J.2
Wareing, J.R.3
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12
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0001364796
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Screening mixtures by affinity NMR
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Lin, M.; Shapiro, M. J.; Wareing, J. R. Screening Mixtures by Affinity NMR. J. Org. Chem. 1997, 62, 8930-8931.
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(1997)
J. Org. Chem.
, vol.62
, pp. 8930-8931
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Lin, M.1
Shapiro, M.J.2
Wareing, J.R.3
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13
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0001467391
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Isotope-filtered affinity NMR
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Gonnella, N.; Lin, M.; Shapiro, M. J.; Wareing, J. R.; Zhang, X. Isotope-Filtered Affinity NMR. J. Magn. Reson. 1998, 131, 336-338.
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(1998)
J. Magn. Reson.
, vol.131
, pp. 336-338
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Gonnella, N.1
Lin, M.2
Shapiro, M.J.3
Wareing, J.R.4
Zhang, X.5
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14
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0006925492
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Pure absorption gradient enhanced heteronuclear single quantum correlation spectroscopy with improved sensitivity
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Kay, L. E.; Keifer, P.; Saarinen, T. Pure Absorption Gradient Enhanced Heteronuclear Single Quantum Correlation Spectroscopy with Improved Sensitivity. J. Am. Chem. Soc. 1992, 114, 10663.
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(1992)
J. Am. Chem. Soc.
, vol.114
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Kay, L.E.1
Keifer, P.2
Saarinen, T.3
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