Author results

4N40
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CRYSTAL STRUCTURE OF HUMAN EPITHELIAL CELL-TRANSFORMING SEQUENCE 2 PROTEIN
Descriptor:Protein ECT2
Authors:Zou, Y., Shao, Z.H., Li, F.D., Gong, D., Wang, C., Gong, Q., Shi, Y.
Deposit date:2013-10-08
Release date:2014-08-27
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (3.106 Å)
Cite:Crystal structure of triple-BRCT-domain of ECT2 and insights into the binding characteristics to CYK-4
Febs Lett., 588, 2014
2I8T
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GDP-MANNOSE MANNOSYL HYDROLASE-CALCIUM-GDP-MANNOSE COMPLEX
Descriptor:GDP-mannose mannosyl hydrolase, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE-ALPHA-D-MANNOSE, ...
Authors:Zou, Y., Li, C., Brunzelle, J.S., Nair, S.K.
Deposit date:2006-09-03
Release date:2007-06-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Molecular basis for substrate selectivity and specificity by an LPS biosynthetic enzyme
Biochemistry, 46, 2007
2I8U
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GDP-MANNOSE MANNOSYL HYDROLASE-CALCIUM-GDP PRODUCT COMPLEX
Descriptor:GDP-mannose mannosyl hydrolase, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE
Authors:Zou, Y., Li, C., Brunzelle, J.S., Nair, S.K.
Deposit date:2006-09-03
Release date:2007-06-19
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Molecular basis for substrate selectivity and specificity by an LPS biosynthetic enzyme
Biochemistry, 46, 2007
3DFF
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THE CRYSTAL STRUCTURE OF TEICOPLANIN PSEUDOAGLYCONE DEACETYLASE ORF2
Descriptor:Teicoplanin pseudoaglycone deacetylases Orf2, ZINC ION, TETRAETHYLENE GLYCOL, ...
Authors:Zou, Y., Brunzelle, J.S., Nair, S.K.
Deposit date:2008-06-11
Release date:2008-07-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structures of lipoglycopeptide antibiotic deacetylases: implications for the biosynthesis of a40926 and teicoplanin.
Chem.Biol., 15, 2008
3DFI
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THE CRYSTAL STRUCTURE OF ANTIMICROBIAL REAGENT A40926 PSEUDOAGLYCONE DEACETYLASE DBV21
Descriptor:Pseudoaglycone deacetylase Dbv21, ZINC ION
Authors:Zou, Y., Brunzelle, J.S., Nair, S.K.
Deposit date:2008-06-12
Release date:2008-07-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structures of lipoglycopeptide antibiotic deacetylases: implications for the biosynthesis of a40926 and teicoplanin.
Chem.Biol., 15, 2008
3DFK
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THE CRYSTAL STRUCTURE OF TEICOPLANIN PSEUDOAGLYCONE DEACETYLASE ORF2* BOUND TO ONE OF ITS PRODUCTS DECANOIC ACID
Descriptor:Teicoplanin pseudoaglycone deacetylase Orf2, ZINC ION, DECANOIC ACID
Authors:Zou, Y., Brunzelle, J.S., Nair, S.K.
Deposit date:2008-06-12
Release date:2008-07-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structures of lipoglycopeptide antibiotic deacetylases: implications for the biosynthesis of a40926 and teicoplanin.
Chem.Biol., 15, 2008
3DFM
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THE CRYSTAL STRUCTURE OF THE ZINC INHIBITED FORM OF TEICOPLANIN DEACETYLASE ORF2
Descriptor:TEICOPLANIN PSEUDOAGLYCONE DEACETYLASE ORF2, ZINC ION, SULFATE ION
Authors:Zou, Y., Brunzelle, J.S., Nair, S.K.
Deposit date:2008-06-12
Release date:2008-07-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Crystal structures of lipoglycopeptide antibiotic deacetylases: implications for the biosynthesis of a40926 and teicoplanin.
Chem.Biol., 15, 2008
3IX3
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LASR-OC12 HSL COMPLEX
Descriptor:Transcriptional activator protein lasR, N-3-OXO-DODECANOYL-L-HOMOSERINE LACTONE
Authors:Zou, Y., Nair, S.K.
Deposit date:2009-09-03
Release date:2009-09-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:LasR-OC12 HSL complex
TO BE PUBLISHED
3IX4
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LASR-TP1 COMPLEX
Descriptor:Transcriptional activator protein lasR, 2,4-dibromo-6-({[(2-nitrophenyl)carbonyl]amino}methyl)phenyl 2-chlorobenzoate
Authors:Zou, Y., Nair, S.K.
Deposit date:2009-09-03
Release date:2009-09-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Molecular basis for the recognition of structurally distinct autoinducer mimics by the Pseudomonas aeruginosa LasR quorum-sensing signaling receptor.
Chem.Biol., 16, 2009
3IX8
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LASR-TP3 COMPLEX
Descriptor:Transcriptional activator protein lasR, 2,4-dibromo-6-({[(2-chlorophenyl)carbonyl]amino}methyl)phenyl 2-methylbenzoate
Authors:Zou, Y., Nair, S.K.
Deposit date:2009-09-03
Release date:2009-09-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Molecular basis for the recognition of structurally distinct autoinducer mimics by the Pseudomonas aeruginosa LasR quorum-sensing signaling receptor.
Chem.Biol., 16, 2009
3JPU
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LASR-TP4 COMPLEX
Descriptor:Transcriptional activator protein lasR, 4-bromo-2-({[(2-chlorophenyl)carbonyl]amino}methyl)-6-methylphenyl 2,4-dichlorobenzoate
Authors:Zou, Y., Nair, S.K.
Deposit date:2009-09-04
Release date:2009-10-13
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Molecular basis for the recognition of structurally distinct autoinducer mimics by the Pseudomonas aeruginosa LasR quorum-sensing signaling receptor.
Chem.Biol., 16, 2009
4E5K
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THERMOSTABLE PHOSPHITE DEHYDROGENASE IN COMPLEX WITH NAD AND SULFITE
Descriptor:Phosphite dehydrogenase (thermostable variant), NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SULFITE ION
Authors:Zou, Y., Zhang, H., Nair, S.K.
Deposit date:2012-03-14
Release date:2012-05-30
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structures of phosphite dehydrogenase provide insights into nicotinamide cofactor regeneration.
Biochemistry, 51, 2012
4E5M
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THERMOSTABLE PHOSPHITE DEHYDROGENASE E175A/A176R IN COMPLEX WITH NADP
Descriptor:Thermostable phosphite dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Zou, Y., Zhang, H., Nair, S.K.
Deposit date:2012-03-14
Release date:2012-05-30
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structures of phosphite dehydrogenase provide insights into nicotinamide cofactor regeneration.
Biochemistry, 51, 2012
4E5N
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THERMOSTABLE PHOSPHITE DEHYDROGENASE IN COMPLEX WITH NAD
Descriptor:Thermostable phosphite dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Zou, Y., Zhang, H., Nair, S.K.
Deposit date:2012-03-14
Release date:2012-05-30
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal structures of phosphite dehydrogenase provide insights into nicotinamide cofactor regeneration.
Biochemistry, 51, 2012
4E5P
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THERMOSTABLE PHOSPHITE DEHYDROGENASE A176R VARIANT IN COMPLEX WITH NAD
Descriptor:Thermostable phosphite dehydrogenase A176R variant, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Zou, Y., Zhang, H., Nair, S.K.
Deposit date:2012-03-14
Release date:2012-05-30
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structures of phosphite dehydrogenase provide insights into nicotinamide cofactor regeneration.
Biochemistry, 51, 2012
4EBF
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SEMET THERMOSTABLE PHOSPHITE DEHYDROGENASE GLU175-ALA MUTANT
Descriptor:Thermostable phosphite dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:Zou, Y., Zhang, H., Nair, S.K.
Deposit date:2012-03-23
Release date:2012-05-30
Last modified:2012-06-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal structures of phosphite dehydrogenase provide insights into nicotinamide cofactor regeneration.
Biochemistry, 51, 2012
4GBR
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N-TERMINAL T4 LYSOZYME FUSION FACILITATES CRYSTALLIZATION OF A G PROTEIN COUPLED RECEPTOR
Descriptor:Beta-2 adrenergic receptor, Lysozyme, (2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)propan-2-ol
Authors:Zou, Y., Weis, W.I., Kobilka, B.K.
Deposit date:2012-07-27
Release date:2012-10-24
Method:X-RAY DIFFRACTION (3.993 Å)
Cite:N-terminal t4 lysozyme fusion facilitates crystallization of a g protein coupled receptor.
Plos One, 7, 2012
2QKW
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STRUCTURAL BASIS FOR ACTIVATION OF PLANT IMMUNITY BY BACTERIAL EFFECTOR PROTEIN AVRPTO
Descriptor:Avirulence protein, Protein kinase
Authors:Xing, W.M., Zou, Y., Liu, Q., Hao, Q., Zhou, J.M., Chai, J.J.
Deposit date:2007-07-11
Release date:2007-08-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:The structural basis for activation of plant immunity by bacterial effector protein AvrPto
Nature, 449, 2007
3D23
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MAIN PROTEASE OF HCOV-HKU1
Descriptor:3C-like proteinase, N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
Authors:Zhao, Q., Chen, C., Li, S., Zou, Y.
Deposit date:2008-05-07
Release date:2008-09-16
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of the main protease from a global infectious human coronavirus, HCoV-HKU1.
J.Virol., 82, 2008
3KJ6
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CRYSTAL STRUCTURE OF A METHYLATED BETA2 ADRENERGIC RECEPTOR-FAB COMPLEX
Descriptor:Beta-2 adrenergic receptor, Fab light chain, Fab heavy chain, ...
Authors:Bokoch, M.P., Zou, Y., Rasmussen, S.G.F., Liu, C.W., Nygaard, R., Rosenbaum, D.M., Fung, J.J., Choi, H.-J., Thian, F.S., Kobilka, T.S., Puglisi, J.D., Weis, W.I., Pardo, L., Prosser, S., Mueller, L., Kobilka, B.K.
Deposit date:2009-11-02
Release date:2010-02-16
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Ligand-specific regulation of the extracellular surface of a G-protein-coupled receptor.
Nature, 463, 2010
3SN6
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CRYSTAL STRUCTURE OF THE BETA2 ADRENERGIC RECEPTOR-GS PROTEIN COMPLEX
Descriptor:Guanine nucleotide-binding protein G(s) subunit alpha isoforms short, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, ...
Authors:Rasmussen, S.G.F., DeVree, B.T., Zou, Y., Kruse, A.C., Chung, K.Y., Kobilka, T.S., Thian, F.S., Chae, P.S., Pardon, E., Calinski, D., Mathiesen, J.M., Shah, S.T.A., Lyons, J.A., Caffrey, M., Gellman, S.H., Steyaert, J., Skiniotis, G., Weis, W.I., Sunahara, R.K., Kobilka, B.K.
Deposit date:2011-06-28
Release date:2011-07-20
Last modified:2017-07-12
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Crystal structure of the beta2 adrenergic receptor-Gs protein complex
Nature, 477, 2011
6MXT
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CRYSTAL STRUCTURE OF HUMAN BETA2 ADRENERGIC RECEPTOR BOUND TO SALMETEROL AND NB71
Descriptor:Endolysin, Beta-2 adrenergic receptor chimera, nanobody Nb71, ...
Authors:Masureel, M., Zou, Y., Picard, L.P., van der Westhuizen, E., Mahoney, J.P., Rodrigues, J.P.G.L.M., Mildorf, T.J., Dror, R.O., Shaw, D.E., Bouvier, M., Pardon, E., Steyaert, J., Sunahara, R.K., Weis, W.I., Zhang, C., Kobilka, B.K.
Deposit date:2018-10-31
Release date:2018-11-14
Method:X-RAY DIFFRACTION (2.959342 Å)
Cite:Structural insights into binding specificity, efficacy and bias of a beta2AR partial agonist.
Nat. Chem. Biol., 14, 2018
6N1S
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TOXOPLASMA GONDII TS-DHFR IN COMPLEX WITH SELECTIVE INHIBITOR 29
Descriptor:Bifunctional dihydrofolate reductase-thymidylate synthase, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Hopper, A.T., Brockman, A., Wise, A., Gould, J., Barks, J., Radke, J.B., Sibley, L.D., Zou, Y., Thomas, S.B.
Deposit date:2018-11-11
Release date:2019-01-23
Method:X-RAY DIFFRACTION (3 Å)
Cite:Discovery of Selective Toxoplasma gondii Dihydrofolate Reductase Inhibitors for the Treatment of Toxoplasmosis.
J. Med. Chem., 2019
6N1T
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TOXOPLASMA GONDII TS-DHFR IN COMPLEX WITH SELECTIVE INHIBITOR 3
Descriptor:Bifunctional dihydrofolate reductase-thymidylate synthase, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Hopper, A.T., Brockman, A., Wise, A., Gould, J., Barks, J., Radke, J.B., Sibley, L.D., Zou, Y., Thomas, S.B.
Deposit date:2018-11-11
Release date:2019-01-23
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Discovery of Selective Toxoplasma gondii Dihydrofolate Reductase Inhibitors for the Treatment of Toxoplasmosis.
J. Med. Chem., 2019
4IVS
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CRYSTAL STRUCTURE OF BACE1 WITH ITS INHIBITOR
Descriptor:Beta-secretase 1, N-{N-[4-(acetylamino)-3,5-dichlorobenzyl]carbamimidoyl}-2-(6-cyano-1H-indol-1-yl)acetamide
Authors:Chen, T.T., Li, L., Chen, W.Y., Xu, Y.C.
Deposit date:2013-01-23
Release date:2013-11-13
Method:X-RAY DIFFRACTION (2.636 Å)
Cite:Virtual screening and structure-based discovery of indole acylguanidines as potent beta-secretase (BACE1) inhibitors
Molecules, 18, 2013
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