Author results

4JXI
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DIRECTED EVOLUTION AND RATIONAL DESIGN OF A DE NOVO DESIGNED ESTERASE TOWARD IMPROVED CATALYSIS. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR184
Descriptor:design cystein esterase, BROMIDE ION, GLYCEROL, ...
Authors:Kuzin, A., Smith, M.D., Richter, F., Lew, S., Seetharaman, R., Bryan, C., Lech, Z., Kiss, G., Moretti, R., Maglaqui, M., Xiao, R., Kohan, E., Smith, M., Everett, J.K., Nguyen, R., Pande, V., Hilvert, D., Kornhaber, G., Baker, D., Montelione, G.T., Hunt, J.F., Tong, L., Northeast Structural Genomics Consortium (NESG)
Deposit date:2013-03-28
Release date:2013-05-22
Method:X-RAY DIFFRACTION (2.29 Å)
Cite:Directed evolution and rational design of a de novo designed esterase toward improved catalysis. Northeast Structural Genomics Consortium (NESG) Target OR184
To be Published
2P05
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STRUCTURAL INSIGHTS INTO THE EVOLUTION OF A NON-BIOLOGICAL PROTEIN
Descriptor:a non-biological ATP binding protein 1819, ZINC ION, CHLORIDE ION, ...
Authors:Smith, M., Rosenow, M., Wang, M., Allen, J.P., Szostak, J.W., Chaput, J.C.
Deposit date:2007-02-28
Release date:2007-06-05
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural insights into the evolution of a non-biological protein: importance of surface residues in protein fold optimization.
PLoS ONE, 2, 2007
2P09
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STRUCTURAL INSIGHTS INTO THE EVOLUTION OF A NON-BIOLOGICAL PROTEIN
Descriptor:a non-biological ATP binding protein with two mutations N32D and D65V, ZINC ION, CHLORIDE ION, ...
Authors:Smith, M., Rosenow, M., Wang, M., Allen, J.P., Szostak, J.W., Chaput, J.C.
Deposit date:2007-02-28
Release date:2007-06-05
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structural insights into the evolution of a non-biological protein: importance of surface residues in protein fold optimization.
PLoS ONE, 2, 2007
3Q96
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B-RAF KINASE DOMAIN IN COMPLEX WITH A TETRAHYDRONAPHTHALENE INHIBITOR
Descriptor:Serine/threonine-protein kinase B-raf, (2S)-N-[3-(2-aminopropan-2-yl)-5-(trifluoromethyl)phenyl]-7-[(7-oxo-5,6,7,8-tetrahydro-1,8-naphthyridin-4-yl)oxy]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
Authors:Sintchak, M.D., Aertgeerts, K., Yano, J.
Deposit date:2011-01-07
Release date:2011-03-23
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Design and optimization of potent and orally bioavailable tetrahydronaphthalene raf inhibitors.
J.Med.Chem., 54, 2011
3IPB
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HUMAN TRANSTHYRETIN (TTR) COMPLEXED WITH A PALINDROMIC BIVALENT AMYLOID INHIBITOR (11 CARBON LINKER).
Descriptor:Transthyretin, 2,2'-{undecane-1,11-diylbis[oxy(3,5-dichlorobenzene-4,1-diyl)imino]}dibenzoic acid
Authors:Kolstoe, S.E., Wood, S.P., Pepys, M.B.
Deposit date:2009-08-17
Release date:2010-11-17
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Trapping of palindromic ligands within native transthyretin prevents amyloid formation.
Proc.Natl.Acad.Sci.USA, 107, 2010
3IPE
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HUMAN TRANSTHYRETIN (TTR) COMPLEXED WITH A PALINDROMIC BIVALENT AMYLOID INHIBITOR (7 CARBON LINKER).
Descriptor:Transthyretin, 2,2'-{heptane-1,7-diylbis[oxy(3,5-dichlorobenzene-4,1-diyl)imino]}dibenzoic acid
Authors:Kolstoe, S.E., Wood, S.P., Pepys, M.B.
Deposit date:2009-08-17
Release date:2010-11-17
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Trapping of palindromic ligands within native transthyretin prevents amyloid formation.
Proc.Natl.Acad.Sci.USA, 107, 2010
3M1O
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HUMAN TRANSTHYRETIN (TTR) COMPLEXED WITH 2-((3,5-DICHLORO-4-HYDROXYPHENYL)AMINO)BENZOIC ACID
Descriptor:Transthyretin, 2-[(3,5-dichloro-4-hydroxyphenyl)amino]benzoic acid
Authors:Kolstoe, S.E., Wood, S.P.
Deposit date:2010-03-05
Release date:2010-11-17
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Trapping of palindromic ligands within native transthyretin prevents amyloid formation.
Proc.Natl.Acad.Sci.USA, 107, 2010
5VNS
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M.TB ANTIGEN 85C ACYL-ENZYME INTERMEDIATE WITH TETRAHYDROLIPSTATIN
Descriptor:Diacylglycerol acyltransferase/mycolyltransferase Ag85C, (2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]-2-HEXYL-3-HYDROXYHEXADECANOIC ACID, (4S)-2-METHYL-2,4-PENTANEDIOL, ...
Authors:Goins, C.M., Ronning, D.R.
Deposit date:2017-05-01
Release date:2018-01-24
Last modified:2018-05-02
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Mycolyltransferase fromMycobacterium tuberculosisin covalent complex with tetrahydrolipstatin provides insights into antigen 85 catalysis.
J. Biol. Chem., 293, 2018