Author results

2C4H
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH 500MM ACETYLTHIOCHOLINE
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, TRIETHYLENE GLYCOL, ...
Authors:Colletier, J.P., Fournier, D., Greenblatt, H.M., Sussman, J.L., Zaccai, G., Silman, I., Weik, M.
Deposit date:2005-10-19
Release date:2006-06-14
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structural insights into substrate traffic and inhibition in acetylcholinesterase.
EMBO J., 25, 2006
2C58
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH 20MM ACETYLTHIOCHOLINE
Descriptor:ACETYLCHOLINESTERASE, 2-(TRIMETHYLAMMONIUM)ETHYL THIOL, ACETYLTHIOCHOLINE, ...
Authors:Colletier, J.P., Fournier, D., Greenblatt, H.M., Sussman, J.L., Zaccai, G., Silman, I., Weik, M.
Deposit date:2005-10-26
Release date:2006-06-14
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural Insights Into Substrate Traffic and Inhibition in Acetylcholinesterase.
Embo J., 25, 2006
2C5F
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH A NON HYDROLYSABLE SUBSTRATE ANALOGUE, 4-OXO-N,N,N-TRIMETHYLPENTANAMINIUM
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, TRIETHYLENE GLYCOL, ...
Authors:Colletier, J.P., Fournier, D., Greenblatt, H.M., Sussman, J.L., Zaccai, G., Silman, I., Weik, M.
Deposit date:2005-10-27
Release date:2006-06-14
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural Insights Into Substrate Traffic and Inhibition in Acetylcholinesterase.
Embo J., 25, 2006
2C5G
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH 20MM THIOCHOLINE
Descriptor:ACETYLCHOLINESTERASE, 2-(TRIMETHYLAMMONIUM)ETHYL THIOL, CHLORIDE ION, ...
Authors:Colletier, J.P., Fournier, D., Greenblatt, H.M., Sussman, J.L., Zaccai, G., Silman, I., Weik, M.
Deposit date:2005-10-27
Release date:2006-06-14
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structural Insights Into Substrate Traffic and Inhibition in Acetylcholinesterase.
Embo J., 25, 2006
2VJA
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH A NON HYDROLYSABLE SUBSTRATE ANALOGUE, 4-OXO-N,N,N- TRIMETHYLPENTANAMINIUM - ORTHORHOMBIC SPACE GROUP - DATASET A AT 100K
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Colletier, J.P., Bourgeois, D., Fournier, D., Silman, I., Sussman, J.L., Weik, M.
Deposit date:2007-12-09
Release date:2008-07-22
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
2VJB
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH A NON HYDROLYSABLE SUBSTRATE ANALOGUE, 4-OXO-N,N,N- TRIMETHYLPENTANAMINIUM - ORTHORHOMBIC SPACE GROUP - DATASET D AT 100K
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Colletier, J.P., Bourgeois, D., Fournier, D., Silman, I., Sussman, J.L., Weik, M.
Deposit date:2007-12-09
Release date:2008-07-22
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
2VJC
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH A NON HYDROLYSABLE SUBSTRATE ANALOGUE, 4-OXO-N,N,N- TRIMETHYLPENTANAMINIUM - ORTHORHOMBIC SPACE GROUP - DATASET A AT 150K
Descriptor:ACETYLCHOLINESTERASE, CHLORIDE ION, (4R)-4-HYDROXY-N,N,N-TRIMETHYLPENTAN-1-AMINIUM, ...
Authors:Colletier, J.P., Bourgeois, D., Fournier, D., Silman, I., Sussman, J.L., Weik, M.
Deposit date:2007-12-09
Release date:2008-07-22
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
2VJD
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH A NON HYDROLYSABLE SUBSTRATE ANALOGUE, 4-OXO-N,N,N- TRIMETHYLPENTANAMINIUM - ORTHORHOMBIC SPACE GROUP - DATASET C AT 150K
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Colletier, J.P., Bourgeois, D., Fournier, D., Silman, I., Sussman, J.L., Weik, M.
Deposit date:2007-12-09
Release date:2008-07-22
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
2VT6
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NATIVE TORPEDO CALIFORNICA ACETYLCHOLINESTERASE COLLECTED WITH A CUMULATED DOSE OF 9400000 GY
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Colletier, J.P., Bourgeois, D., Sanson, B., Fournier, D., Sussman, J.L., Silman, I., Weik, M.
Deposit date:2008-05-09
Release date:2008-07-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
2VT7
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NATIVE TORPEDO CALIFORNICA ACETYLCHOLINESTERASE COLLECTED WITH A CUMULATED DOSE OF 800000 GY
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Colletier, J.P., Bourgeois, D., Sanson, B., Fournier, D., Sussman, J.L., Silman, I., Weik, M.
Deposit date:2008-05-09
Release date:2008-07-22
Last modified:2016-01-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Shoot-and-Trap: Use of Specific X-Ray Damage to Study Structural Protein Dynamics by Temperature-Controlled Cryo-Crystallography.
Proc.Natl.Acad.Sci.USA, 105, 2008
3ZZN
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5-MUTANT (R79W, R151A, E279A, E299A,E313A) LACTATE-DEHYDROGENASE FROM THERMUS THERMOPHILLUS
Descriptor:LACTATE DEHYDROGENASE, ADENOSINE-5'-DIPHOSPHATE
Authors:Colletier, J.P., Mraihi, S., Madern, D.
Deposit date:2011-09-02
Release date:2012-02-08
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Sampling the conformational energy landscape of a hyperthermophilic protein by engineering key substitutions.
Mol. Biol. Evol., 29, 2012
2CEK
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CONFORMATIONAL FLEXIBILITY IN THE PERIPHERAL SITE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE REVEALED BY THE COMPLEX STRUCTURE WITH A BIFUNCTIONAL INHIBITOR
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, N-[8-(1,2,3,4-TETRAHYDROACRIDIN-9-YLTHIO)OCTYL]-1,2,3,4-TETRAHYDROACRIDIN-9-AMINE, ...
Authors:Sanson, B., Colletier, J.P., Nachon, F., Gabellieri, E., Fattorusso, C., Campiani, G., Weik, M.
Deposit date:2006-02-08
Release date:2006-04-10
Last modified:2018-07-25
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Conformational flexibility in the peripheral site of Torpedo californica acetylcholinesterase revealed by the complex structure with a bifunctional inhibitor.
J. Am. Chem. Soc., 128, 2006
5N9I
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STRUCTURE OF 206-GVVTSE-211, THE STERIC ZIPPER THAT SUPPORTS THE SELF-ASSOCIATION OF P. STUARTII OMP-PST1 INTO DIMERS OF TRIMERS
Descriptor:Porin 1
Authors:Colletier, J.P., Nasrallah, C.
Deposit date:2017-02-24
Release date:2018-02-21
Last modified:2018-03-14
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Porin self-association enables cell-to-cell contact in
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
5NXR
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TRIMERIC STRUCTURE OF OMP-PST1, THE MAJOR PORIN FROM PROVIDENCIA STUARTII
Descriptor:Porin 1, LAURYL DIMETHYLAMINE-N-OXIDE, CALCIUM ION, ...
Authors:Colletier, J.P., Nasrallah, C.
Deposit date:2017-05-10
Release date:2018-02-21
Last modified:2019-02-06
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Porin self-association enables cell-to-cell contact in
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
5NXU
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COMPLEX STRUCTURE WITH MALTOSE OF PROVIDENCIA STUARTII OMP-PST1 PORIN
Descriptor:Porin 1, LAURYL DIMETHYLAMINE-N-OXIDE, MALTOSE, ...
Authors:Colletier, J.P., Nasrallah, C.
Deposit date:2017-05-10
Release date:2018-02-21
Last modified:2018-03-14
Method:X-RAY DIFFRACTION (3 Å)
Cite:Porin self-association enables cell-to-cell contact in
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4D64
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STRUCTURE OF PORIN OMP-PST1 FROM P. STUARTII; THE CRYSTALLOGRAPHIC SYMMETRY GENERATES A DIMER OF TRIMERS.
Descriptor:PORIN 1, CALCIUM ION
Authors:Nasrallah, C., Colletier, J.P.
Deposit date:2014-11-08
Release date:2016-03-09
Last modified:2018-04-18
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Porin self-association enables cell-to-cell contact inProvidencia stuartiifloating communities.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
4D65
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STRUCTURE OF PORIN OMP-PST2 FROM P. STUARTII; THE ASYMMETRIC UNIT CONTAINS A DIMER OF TRIMERS.
Descriptor:PORIN 2, LAURYL DIMETHYLAMINE-N-OXIDE, 3-HYDROXY-TETRADECANOIC ACID, ...
Authors:Nasrallah, C., Colletier, J.P.
Deposit date:2014-11-08
Release date:2016-03-09
Last modified:2018-04-18
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Porin self-association enables cell-to-cell contact inProvidencia stuartiifloating communities.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
2WFZ
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NON-AGED CONJUGATE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE WITH SOMAN
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, ALPHA-L-FUCOSE, ...
Authors:Sanson, B., Nachon, F., Colletier, J.P., Froment, M.T., Toker, L., Greenblatt, H.M., Sussman, J.L., Ashani, Y., Masson, P., Silman, I., Weik, M.
Deposit date:2009-04-15
Release date:2009-08-11
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystallographic Snapshots of Nonaged and Aged Conjugates of Soman with Acetylcholinesterase, and of a Ternary Complex of the Aged Conjugate with Pralidoxime.
J.Med.Chem., 52, 2009
2WG0
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AGED CONJUGATE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE WITH SOMAN (OBTAINED BY IN CRYSTALLO AGING)
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, CHLORIDE ION, ...
Authors:Sanson, B., Nachon, F., Colletier, J.P., Froment, M.T., Toker, L., Greenblatt, H.M., Sussman, J.L., Ashani, Y., Masson, P., Silman, I., Weik, M.
Deposit date:2009-04-15
Release date:2009-08-11
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystallographic Snapshots of Nonaged and Aged Conjugates of Soman with Acetylcholinesterase, and of a Ternary Complex of the Aged Conjugate with Pralidoxime.
J.Med.Chem., 52, 2009
2WG1
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TERNARY COMPLEX OF THE AGED CONJUGATE OF TORPEDO CALIFORNICA ACEYLCHOLINESTERASE WITH SOMAN AND 2-PAM
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, ALPHA-L-FUCOSE, ...
Authors:Sanson, B., Nachon, F., Colletier, J.P., Froment, M.T., Toker, L., Greenblatt, H.M., Sussman, J.L., Ashani, Y., Masson, P., Silman, I., Weik, M.
Deposit date:2009-04-15
Release date:2009-08-11
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystallographic Snapshots of Nonaged and Aged Conjugates of Soman with Acetylcholinesterase, and of a Ternary Complex of the Aged Conjugate with Pralidoxime.
J.Med.Chem., 52, 2009
2WG2
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NON-AGED CONJUGATE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE WITH SOMAN (ALTERNATIVE REFINEMENT)
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, ALPHA-L-FUCOSE, ...
Authors:Sanson, B., Nachon, F., Colletier, J.P., Froment, M.T., Toker, L., Greenblatt, H.M., Sussman, J.L., Ashani, Y., Masson, P., Silman, I., Weik, M.
Deposit date:2009-04-15
Release date:2010-04-21
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystallographic Snapshots of Nonaged and Aged Conjugates of Soman with Acetylcholinesterase, and of a Ternary Complex of the Aged Conjugate with Pralidoxime.
J.Med.Chem., 52, 2009
2X8B
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CRYSTAL STRUCTURE OF HUMAN ACETYLCHOLINESTERASE INHIBITED BY AGED TABUN AND COMPLEXED WITH FASCICULIN-II
Descriptor:ACETHYLCHOLINESTERASE, FASCICULIN-2, CHLORIDE ION, ...
Authors:Carletti, E., Colletier, J.P., Nachon, F.
Deposit date:2010-03-08
Release date:2010-04-28
Last modified:2018-02-28
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Structural evidence that human acetylcholinesterase inhibited by tabun ages through O-dealkylation.
J. Med. Chem., 53, 2010
2XI4
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH AFLATOXIN B1 (ORTHORHOMBIC SPACE GROUP)
Descriptor:ACETYLCHOLINESTERASE, AFLATOXIN B1, CHLORIDE ION, ...
Authors:Sanson, B., Colletier, J.P., Xu, Y., Lang, P.T., Jiang, H., Silman, I., Sussman, J.L., Weik, M.
Deposit date:2010-06-28
Release date:2011-03-23
Last modified:2019-04-03
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Backdoor Opening Mechanism in Acetylcholinesterase Based on X-Ray Crystallography and Molecular Dynamics Simulations.
Protein Sci., 20, 2011
2Y1K
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STRUCTURE OF HUMAN BUTYRYLCHOLINESTERASE INHIBITED BY CBDP (12H SOAK): PHOSPHOSERINE ADDUCT
Descriptor:CHOLINESTERASE, SULFATE ION, SODIUM ION, ...
Authors:Carletti, E., Colletier, J.P., Nachon, F., Weik, M.
Deposit date:2010-12-08
Release date:2011-06-29
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Reaction of Cresyl Saligenin Phosphate, the Organophosphorus Agent Implicated in Aerotoxic Syndrome, with Human Cholinesterases: Mechanistic Studies Employing Kinetics, Mass Spectrometry, and X-Ray Structure Analysis.
Chem.Res.Toxicol., 24, 2011
4TPK
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HUMAN BUTYRYLCHOLINESTERASE IN COMPLEX WITH N-((1-(2,3-DIHYDRO-1H-INDEN-2-YL)PIPERIDIN-3-YL)METHYL)-N-(2-METHOXYETHYL)-2-NAPHTHAMIDE
Descriptor:Cholinesterase, N-ACETYL-D-GLUCOSAMINE, BETA-L-FUCOSE, ...
Authors:Coquelle, N., Brus, B., Colletier, J.P., Gobec, S.
Deposit date:2014-06-07
Release date:2014-10-22
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Discovery, biological evaluation, and crystal structure of a novel nanomolar selective butyrylcholinesterase inhibitor.
J.Med.Chem., 57, 2014