Author results

2BC3
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T7-TAGGED FULL-LENGTH STREPTAVIDIN
Descriptor:Streptavidin, GLYCEROL, SULFATE ION
Authors:Stenkamp, R.E., Le Trong, I., Ward, T.R., Humbert, N.
Deposit date:2005-10-18
Release date:2005-10-25
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Crystallographic Analysis of a Full-length Streptavidin with Its C-terminal Polypeptide Bound in the Biotin Binding Site.
J.Mol.Biol., 356, 2006
2QCB
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T7-TAGGED FULL-LENGTH STREPTAVIDIN COMPLEXED WITH RUTHENIUM LIGAND
Descriptor:Streptavidin, N-(4-{[(2-AMINOETHYL)AMINO]SULFONYL}PHENYL)-5-[(3AS,4S,6AR)-2-OXOHEXAHYDRO-1H-THIENO[3,4-D]IMIDAZOL-4-YL]PENTANAMIDE-(1,2,3,4,5,6-ETA)-BENZENE-CHLORO-RUTHENIUM(III)
Authors:Le Trong, I., Creus, M., Pordea, A., Ward, T.R., Stenkamp, R.E.
Deposit date:2007-06-19
Release date:2008-04-29
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:X-ray structure and designed evolution of an artificial transfer hydrogenase
Angew.Chem.Int.Ed.Engl., 47, 2008
2WPU
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CHAPERONED RUTHENIUM METALLODRUGS THAT RECOGNIZE TELOMERIC DNA
Descriptor:STREPTAVIDIN, (3AS,4S,6AR)-4-(5-((3R,4R)-3,4-DIAMINOPYRROLIDIN-1-YL)-5-OXOPENTYL)TETRAHYDRO-1H-THIENO[3,4-D]IMIDAZOL-2(3H)-ONE-P-CYMENE-CHLORO-RUTHENIUM(III), SULFATE ION, ...
Authors:Heinisch, T., Schirmer, T., Zimbron, J.M., Sardo, A., Wohlschlager, T., Gradinaru, J., Creus, M., Ward, T.R.
Deposit date:2009-08-10
Release date:2010-10-13
Last modified:2019-02-06
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:Chemo-Genetic Optimization of DNA Recognition by Metallodrugs Using a Presenter-Protein Strategy.
Chemistry, 16, 2010
5BRU
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CATALYTIC IMPROVEMENT OF AN ARTIFICIAL METALLOENZYME BY COMPUTATIONAL DESIGN
Descriptor:Carbonic anhydrase 2, ZINC ION, chloro[(phenylsulfonyl){[4-(4-sulfamoylphenyl)pyridin-2-yl-kappaN]methyl}azanide-kappaN][(1,2,3,4,5-eta)-1,2,3,4-tetramethyl-5-propylcyclopentadienyl]iridium, ...
Authors:Heinisch, T., Pellizzoni, M., Duerrenberger, M., Tinberg, C.E., Koehler, V., Klehr, J., Haeussinger, D., Baker, D., Ward, T.R.
Deposit date:2015-06-01
Release date:2015-06-24
Last modified:2015-08-26
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Improving the Catalytic Performance of an Artificial Metalloenzyme by Computational Design.
J.Am.Chem.Soc., 137, 2015
5BRV
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CATALYTIC IMPROVEMENT OF AN ARTIFICIAL METALLOENZYME BY COMPUTATIONAL DESIGN
Descriptor:Carbonic anhydrase 2, ZINC ION, pentamethylcyclopentadienyl iridium [N-benzensulfonamide-(2-pyridylmethyl-4-benzensulfonamide)amin] chloride
Authors:Heinisch, T., Pellizzoni, M., Duerrenberger, M., Tinberg, C.E., Koehler, V., Klehr, J., Haeussinger, D., Baker, D., Ward, T.R.
Deposit date:2015-06-01
Release date:2015-06-24
Last modified:2015-08-26
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Improving the Catalytic Performance of an Artificial Metalloenzyme by Computational Design.
J.Am.Chem.Soc., 137, 2015
5BRW
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CATALYTIC IMPROVEMENT OF AN ARTIFICIAL METALLOENZYME BY COMPUTATIONAL DESIGN
Descriptor:Carbonic anhydrase 2, ZINC ION, SULFATE ION, ...
Authors:Heinisch, T., Pellizzoni, M., Duerrenberger, M., Tinberg, C.E., Koehler, V., Klehr, J., Haeussinger, D., Baker, D., Ward, T.R.
Deposit date:2015-06-01
Release date:2015-06-17
Last modified:2015-08-26
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Improving the Catalytic Performance of an Artificial Metalloenzyme by Computational Design.
J.Am.Chem.Soc., 137, 2015
5CSE
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STREPTAVIDIN-S112Y-K121E COMPLEXED WITH PALLADIUM-CONTAINING BIOTIN LIGAND
Descriptor:Streptavidin, chloro{di-tert-butyl[2-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)ethyl]-lambda~5~-phosphanyl}(1-phenylprop-1-ene-1,3-diyl-kappa~2~C~1~,C~3~)palladium, CHLORIDE ION
Authors:Finke, A.D., Vera, L., Marsh, M., Chatterjee, A., Ward, T.R.
Deposit date:2015-07-23
Release date:2015-11-04
Last modified:2018-07-11
Method:X-RAY DIFFRACTION (1.792 Å)
Cite:An enantioselective artificial Suzukiase based on the biotin-streptavidin technology.
Chem Sci, 7, 2016
5F2B
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EXPANDING NATURE'S CATALYTIC REPERTOIRE -DIRECTED EVOLUTION OF AN ARTIFICIAL METALLOENZYME FOR IN VIVO METATHESIS
Descriptor:Streptavidin, [1-[4-[[5-[(3~{a}~{S},4~{S},6~{a}~{R})-2-oxidanylidene-1,3,3~{a},4,6,6~{a}-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]methyl]-2,6-dimethyl-phenyl]-3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-2-yl]-bis(chloranyl)ruthenium, SULFATE ION
Authors:Heinisch, T., Jeschek, M., Reuter, R., Trindler, C., Panke, S., Ward, T.R.
Deposit date:2015-12-01
Release date:2016-08-31
Last modified:2016-10-05
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Directed evolution of artificial metalloenzymes for in vivo metathesis.
Nature, 537, 2016
5IRA
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EXPANDING NATURE'S CATALYTIC REPERTOIRE -DIRECTED EVOLUTION OF AN ARTIFICIAL METALLOENZYME FOR IN VIVO METATHESIS
Descriptor:Artificial Metathesase, [1-[4-[[5-[(3~{a}~{S},4~{S},6~{a}~{R})-2-oxidanylidene-1,3,3~{a},4,6,6~{a}-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]methyl]-2,6-dimethyl-phenyl]-3-(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-1-ium-2-yl]-bis(chloranyl)ruthenium
Authors:Heinisch, T., Jeschek, M., Reuter, R., Trindler, C., Panke, S., Ward, T.R.
Deposit date:2016-03-12
Release date:2016-08-31
Last modified:2016-10-05
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Directed evolution of artificial metalloenzymes for in vivo metathesis.
Nature, 537, 2016
5K67
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DESIGNED ARTIFICIAL CUPREDOXINS
Descriptor:Streptavidin, [CuII(biot-pr-dpea)]2+, GLYCEROL
Authors:Mann, S.I., Heinisch, T., Weitz, A.C., Hendrich, M.R., Ward, T.R., Borovik, A.S.
Deposit date:2016-05-24
Release date:2016-07-20
Last modified:2018-05-09
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Modular Artificial Cupredoxins.
J.Am.Chem.Soc., 138, 2016
5K68
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DESIGNED ARTIFICIAL CUPREDOXINS
Descriptor:Streptavidin, [CuII(biot-bu-dpea)]2+
Authors:Mann, S.I., Heinisch, T., Weitz, A.C., Hendrich, M.R., Ward, T.R., Borovik, A.S.
Deposit date:2016-05-24
Release date:2016-07-20
Last modified:2019-11-27
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Modular Artificial Cupredoxins.
J.Am.Chem.Soc., 138, 2016
5L3Y
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DESIGNED ARTIFICIAL CUPREDOXINS
Descriptor:Streptavidin, [CuII(biot-et-dpea)]2+
Authors:Mann, S.I., Heinisch, T., Weitz, A.C., Hendrich, M.R., Ward, T.R., Borovik, A.S.
Deposit date:2016-05-24
Release date:2016-07-20
Last modified:2019-11-27
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Modular Artificial Cupredoxins.
J.Am.Chem.Soc., 138, 2016
5VL5
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COORDINATION CHEMISTRY WITHIN A PROTEIN HOST: REGULATION OF THE SECONDARY COORDINATION SPHERE
Descriptor:Streptavidin, [N-(3-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}propyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide](azido)(hydroxy)copper, COPPER (II) ION
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-04-24
Release date:2018-04-18
Last modified:2018-05-09
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:Coordination chemistry within a protein host: regulation of the secondary coordination sphere.
Chem. Commun. (Camb.), 54, 2018
5VL8
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COORDINATION CHEMISTRY WITHIN A PROTEIN HOST: REGULATION OF THE SECONDARY COORDINATION SPHERE
Descriptor:Streptavidin, [N-(3-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}propyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide](hydroxy)copper, COPPER (II) ION, ...
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-04-25
Release date:2018-04-18
Last modified:2018-05-09
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Coordination chemistry within a protein host: regulation of the secondary coordination sphere.
Chem. Commun. (Camb.), 54, 2018
5WBA
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PEROXIDE ACTIVATION REGULATED BY HYDROGEN BONDS WITHIN ARTIFICIAL CU PROTEINS - WT
Descriptor:Streptavidin, [N-(2-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}ethyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide](hydrogen peroxido-kappaO)copper, ACETATE ION, ...
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-06-28
Release date:2017-11-22
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Peroxide Activation Regulated by Hydrogen Bonds within Artificial Cu Proteins.
J. Am. Chem. Soc., 139, 2017
5WBB
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PEROXIDE ACTIVATION REGULATED BY HYDROGEN BONDS WITHIN ARTIFICIAL CU PROTEINS - S112A
Descriptor:Streptavidin, [N-(2-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}ethyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide]copper, COPPER (II) ION, ...
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-06-28
Release date:2017-11-22
Last modified:2017-12-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Peroxide Activation Regulated by Hydrogen Bonds within Artificial Cu Proteins.
J. Am. Chem. Soc., 139, 2017
5WBC
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DESIGNED ARTIFICIAL CUPREDOXINS - WT
Descriptor:Streptavidin, [CuII(biot-et-dpea)]2+, GLYCEROL, ...
Authors:Mann, S.I., Heinisch, T., Weitz, A.C., Hendrich, M.R., Ward, T.R., Borovik, A.S.
Deposit date:2017-06-28
Release date:2017-08-16
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Modular Artificial Cupredoxins.
J. Am. Chem. Soc., 138, 2016
5WBD
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PEROXIDE ACTIVATION REGULATED BY HYDROGEN BONDS WITHIN ARTIFICIAL CU PROTEINS - N49A
Descriptor:Streptavidin, [N-(2-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}ethyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide](hydroxy)copper, ACETATE ION
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-06-28
Release date:2017-11-22
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Peroxide Activation Regulated by Hydrogen Bonds within Artificial Cu Proteins.
J. Am. Chem. Soc., 139, 2017
6ANX
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PEROXIDE ACTIVATION REGULATED BY HYDROGEN BONDS WITHIN ARTIFICIAL CU PROTEINS - WT (LOW EXPOSURE)
Descriptor:Streptavidin, [N-(2-{bis[2-(pyridin-2-yl-kappaN)ethyl]amino-kappaN}ethyl)-5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide](hydrogen peroxido-kappaO)hydroxycopper, ACETATE ION, ...
Authors:Mann, S.I., Heinisch, T., Ward, T.R., Borovik, A.S.
Deposit date:2017-08-14
Release date:2017-11-22
Last modified:2020-01-01
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Peroxide Activation Regulated by Hydrogen Bonds within Artificial Cu Proteins.
J. Am. Chem. Soc., 139, 2017
6ESS
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ARTIFICIAL IMINE REDUCTASE MUTANT S112A-N118P-K121A-S122M
Descriptor:Streptavidin, {N-(4-{[2-(amino-kappaN)ethyl]sulfamoyl-kappaN}phenyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide}(chloro)[(1,2,3,4,5-eta)-1,2,3,4,5-pentamethylcyclopentadienyl]iridium(III), IRIDIUM ION
Authors:Hestericova, M., Heinisch, T., Alonso-Cotchico, L., Marechal, J.-D., Vidossich, P., Ward, T.R.
Deposit date:2017-10-24
Release date:2018-01-03
Last modified:2018-02-14
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Directed Evolution of an Artificial Imine Reductase.
Angew. Chem. Int. Ed. Engl., 57, 2018
6ESU
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ARTIFICIAL IMINE REDUCTASE MUTANT S112A-N118P-K121A-S122M
Descriptor:Streptavidin, 5-[(3~{a}~{S},4~{S},6~{a}~{R})-2-oxidanylidene-1,3,3~{a},4,6,6~{a}-hexahydrothieno[3,4-d]imidazol-4-yl]-~{N}-[4-(2-azanylethylsulfamoyl)phenyl]pentanamide, IRIDIUM ION, ...
Authors:Hestericova, M., Heinisch, T., Alonso-Cotchico, L., Marechal, J.-D., Vidossich, P., Ward, T.R.
Deposit date:2017-10-24
Release date:2018-01-03
Last modified:2018-02-14
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Directed Evolution of an Artificial Imine Reductase.
Angew. Chem. Int. Ed. Engl., 57, 2018
6FH8
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E. COLI SURFACE DISPLAY OF STREPTAVIDIN FOR DIRECTED EVOLUTION OF AN ALLYLIC DEALLOCASE
Descriptor:Streptavidin, biotinylated ruthenium cyclopentadienide
Authors:Heinisch, T., Schwizer, F., Garabedian, B., Csibra, E., Jeschek, M., Pinheiro Bernhardes, V., Marliere, P., Panke, S., Ward, T.R.
Deposit date:2018-01-12
Release date:2018-08-22
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:E. colisurface display of streptavidin for directed evolution of an allylic deallylase.
Chem Sci, 9, 2018
6FRY
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PHOTO-DRIVEN HYDROGEN EVOLUTION BY AN ARTIFICIAL HYDROGENASE UTILIZING THE BIOTIN-STREPTAVIDIN TECHNOLOGY
Descriptor:Streptavidin, [CoBr(appy)-Biot]Br
Authors:Keller, S., Probst, B., Heinisch, T., Alberto, R., Ward, T.R.
Deposit date:2018-02-16
Release date:2019-03-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Photo-Driven Hydrogen Evolution by an Artificial Hydrogenase Utilizing the Biotin-Streptavidin Technology
To Be Published
6UI0
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ARTIFICIAL IRON PROTEINS: MODELLING THE ACTIVE SITES IN NON-HEME DIOXYGENASES
Descriptor:Streptavidin, {N-(2-{bis[(pyridin-2-yl-kappaN)methyl]amino-kappaN}ethyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide}iron(3+), ACETATE ION
Authors:Miller, K.R., Paretsky, J.D., Follmer, A.H., Heinisch, T., Mittra, K., Gul, S., Kim, I.-S., Fuller, F.D., Batyuk, A., Sutherlin, K.D., Brewster, A.S., Bhowmick, A., Sauter, N.K., Kern, J., Yano, J., Green, M.T., Ward, T.R., Borovik, A.S.
Deposit date:2019-09-29
Release date:2020-05-06
Last modified:2020-05-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Artificial Iron Proteins: Modeling the Active Sites in Non-Heme Dioxygenases.
Inorg.Chem., 59, 2020
6UIU
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ARTIFICIAL IRON PROTEINS: MODELLING THE ACTIVE SITES IN NON-HEME DIOXYGENASES
Descriptor:Streptavidin, N-(2-{bis[(pyridin-2-yl)methyl]amino}ethyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Authors:Miller, K.R., Paretsky, J.D., Follmer, A.H., Heinisch, T., Mittra, K., Gul, S., Kim, I.-S., Fuller, F.D., Batyuk, A., Sutherlin, K.D., Brewster, A.S., Bhowmick, A., Sauter, N.K., Kern, J., Yano, J., Green, M.T., Ward, T.R., Borovik, A.S.
Deposit date:2019-10-01
Release date:2020-05-06
Last modified:2020-05-13
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:Artificial Iron Proteins: Modeling the Active Sites in Non-Heme Dioxygenases.
Inorg.Chem., 59, 2020
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