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1ODC
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STRUCTURE OF ACETYLCHOLINESTERASE (E.C. 3.1.1.7) COMPLEXED WITH N-4'-QUINOLYL-N'-9"-(1",2",3",4"-TETRAHYDROACRIDINYL)-1,8- DIAMINOOCTANE AT 2.2A RESOLUTION
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, N-QUINOLIN-4-YL-N'-(1,2,3,4-TETRAHYDROACRIDIN-9-YL)OCTANE-1,8-DIAMINE
Authors:Wong, D.M., Greenblatt, H.M., Carlier, P.R., Han, Y.-F., Pang, Y.-P., Silman, I., Sussman, J.L.
Deposit date:2003-02-15
Release date:2005-03-23
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Complexes of Alkylene-Linked Tacrine Dimers with Torpedo Californica Acetylcholinesterase: Binding of Bis(5)-Tacrine Produces a Dramatic Rearrangement in the Active-Site Gorge.
J.Med.Chem., 49, 2006
1UT6
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STRUCTURE OF ACETYLCHOLINESTERASE (E.C. 3.1.1.7) COMPLEXED WITH N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8- DIAMINOOCTANE AT 2.4 ANGSTROMS RESOLUTION.
Descriptor:ACETYLCHOLINESTERASE, N-ACETYL-D-GLUCOSAMINE, N-9-(1',2',3',4'-TETRAHYDROACRIDINYL)-1,8-DIAMINOOCTANE
Authors:Brumshtein, B., Wong, D.M., Greenblatt, H.M., Carlier, P.R., Pang, Y.-P., Silman, I., Sussman, J.L.
Deposit date:2003-12-04
Release date:2005-04-21
Last modified:2016-09-28
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Complexes of Alkylene-Linked Tacrine Dimers with Torpedo Californica Acetylcholinesterase: Binding of Bis(5)-Tacrine Produces a Dramatic Rearrangement in the Active-Site Gorge.
J.Med.Chem., 49, 2006
1ZGB
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CRYSTAL STRUCTURE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH AN (R)-TACRINE(10)-HUPYRIDONE INHIBITOR.
Descriptor:Acetylcholinesterase, N-ACETYL-D-GLUCOSAMINE, (5R)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE
Authors:Haviv, H., Wong, D.M., Greenblatt, H.M., Carlier, P.R., Pang, Y.P., Silman, I., Sussman, J.L., Israel Structural Proteomics Center (ISPC)
Deposit date:2005-04-21
Release date:2005-08-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystal Packing Mediates Enantioselective Ligand Recognition at the Peripheral Site of Acetylcholinesterase
J.Am.Chem.Soc., 127, 2005
1ZGC
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CRYSTAL STRUCTURE OF TORPEDO CALIFORNICA ACETYLCHOLINESTERASE IN COMPLEX WITH AN (RS)-TACRINE(10)-HUPYRIDONE INHIBITOR.
Descriptor:Acetylcholinesterase, N-ACETYL-D-GLUCOSAMINE, (5S)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE
Authors:Haviv, H., Wong, D.M., Greenblatt, H.M., Carlier, P.R., Pang, Y.P., Silman, I., Sussman, J.L., Israel Structural Proteomics Center (ISPC)
Deposit date:2005-04-21
Release date:2005-08-16
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Packing Mediates Enantioselective Ligand Recognition at the Peripheral Site of Acetylcholinesterase
J.Am.Chem.Soc., 127, 2005
1H22
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STRUCTURE OF ACETYLCHOLINESTERASE (E.C. 3.1.1.7) COMPLEXED WITH (S,S)-(-)-BIS(10)-HUPYRIDONE AT 2.15A RESOLUTION
Descriptor:ACETYLCHOLINESTERASE, (S,S)-(-)-N,N'-DI-5'-[5',6',7',8'-TETRAHYDRO- 2'(1'H)-QUINOLYNYL]-1,10-DIAMINODECANE DIHYDROCHLORIDE, N-ACETYL-D-GLUCOSAMINE
Authors:Wong, D.M., Greenblatt, H.M., Carlier, P.R., Han, Y.-F., Pang, Y.-P., Silman, I., Sussman, J.L.
Deposit date:2002-07-30
Release date:2002-12-23
Last modified:2014-01-22
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Acetylcholinesterase Complexed with Bivalent Ligands Related to Huperzine A: Experimental Evidence for Species-Dependent Protein-Ligand Complementarity
J.Am.Chem.Soc., 125, 2003
1H23
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STRUCTURE OF ACETYLCHOLINESTERASE (E.C. 3.1.1.7) COMPLEXED WITH (S,S)-(-)-BIS(12)-HUPYRIDONE AT 2.15A RESOLUTION
Descriptor:ACETYLCHOLINESTERASE, (S,S)-(-)-N,N'-DI-5'-[5',6',7',8'-TETRAHYDRO- 2'(1'H)-QUINOLYNYL]-1,12-DIAMINODODECANE DIHYDROCHLORIDE, N-ACETYL-D-GLUCOSAMINE
Authors:Wong, D.M., Greenblatt, H.M., Carlier, P.R., Han, Y.F., Pang, Y.P., Silman, I., Sussman, J.L.
Deposit date:2002-07-30
Release date:2002-12-23
Last modified:2014-01-22
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Acetylcholinesterase Complexed with Bivalent Ligands Related to Huperzine A: Experimental Evidence for Species-Dependent Protein-Ligand Complementarity
J.Am.Chem.Soc., 125, 2003
2CKM
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE COMPLEXED WITH ALKYLENE- LINKED BIS-TACRINE DIMER (7 CARBON LINKER)
Descriptor:ACETYLCHOLINESTERASE, N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLHEPTANE-1,7-DIAMINE, N-ACETYL-D-GLUCOSAMINE
Authors:Brumshtein, B., Rydberg, E.H., Greenblatt, H.M., Wong, D.M., Shaya, D., Williams, L.D., Carlier, P.R., Pang, Y.P., Silman, I., Sussman, J.L.
Deposit date:2006-04-20
Release date:2006-09-04
Last modified:2019-02-13
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Complexes of alkylene-linked tacrine dimers with Torpedo californica acetylcholinesterase: Binding of Bis5-tacrine produces a dramatic rearrangement in the active-site gorge.
J. Med. Chem., 49, 2006
5X61
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CRYSTAL STRUCTURE OF ACETYLCHOLINESTERASE CATALYTIC SUBUNIT OF THE MALARIA VECTOR ANOPHELES GAMBIAE, 3.4 A
Descriptor:Acetylcholinesterase, SULFATE ION, N-ACETYL-D-GLUCOSAMINE, ...
Authors:Han, Q., Robinson, H., Ding, H., Wong, D.M., Lam, P.C.H., Totrov, M.M., Carlier, P.R., Li, J.
Deposit date:2017-02-20
Release date:2017-03-15
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Crystal structure of acetylcholinesterase catalytic subunits of the malaria vector Anopheles gambiae
Insect Sci., 2017
6ARX
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CRYSTAL STRUCTURE OF AN INSECTICIDE-RESISTANT ACETYLCHOLINESTERASE MUTANT FROM THE MALARIA VECTOR ANOPHELES GAMBIAE IN THE LIGAND-FREE STATE
Descriptor:Acetylcholinesterase, N-ACETYL-D-GLUCOSAMINE, CITRATE ANION, ...
Authors:Cheung, J., Mahmood, A., Kalathur, R., Lixuan, L., Carlier, P.R.
Deposit date:2017-08-23
Release date:2018-01-10
Method:X-RAY DIFFRACTION (2.302 Å)
Cite:Structure of the G119S Mutant Acetylcholinesterase of the Malaria Vector Anopheles gambiae Reveals Basis of Insecticide Resistance.
Structure, 26, 2018
6ARY
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CRYSTAL STRUCTURE OF AN INSECTICIDE-RESISTANT ACETYLCHOLINESTERASE MUTANT FROM THE MALARIA VECTOR ANOPHELES GAMBIAE IN COMPLEX WITH A DIFLUOROMETHYL KETONE INHIBITOR
Descriptor:Acetylcholinesterase, (1S)-2,2-difluoro-1-[1-(pentan-3-yl)-1H-pyrazol-4-yl]ethan-1-ol, N-ACETYL-D-GLUCOSAMINE, ...
Authors:Cheung, J., Mahmood, A., Kalathur, R., Lixuan, L., Carlier, P.R.
Deposit date:2017-08-23
Release date:2018-01-10
Method:X-RAY DIFFRACTION (2.257 Å)
Cite:Structure of the G119S Mutant Acetylcholinesterase of the Malaria Vector Anopheles gambiae Reveals Basis of Insecticide Resistance.
Structure, 26, 2018
2CMF
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TORPEDO CALIFORNICA ACETYLCHOLINESTERASE COMPLEXED WITH ALKYLENE- LINKED BIS-TACRINE DIMER (5 CARBON LINKER)
Descriptor:ACETYLCHOLINESTERASE, N,N'-DI-1,2,3,4-TETRAHYDROACRIDIN-9-YLPENTANE-1,5-DIAMINE, N-ACETYL-D-GLUCOSAMINE
Authors:Rydberg, E.H., Brumshtein, B., Greenblatt, H.M., Wong, D.M., Pang, Y.P., Silman, I., Sussman, J.L.
Deposit date:2006-05-08
Release date:2006-09-04
Last modified:2019-02-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Complexes of alkylene-linked tacrine dimers with Torpedo californica acetylcholinesterase: Binding of Bis5-tacrine produces a dramatic rearrangement in the active-site gorge.
J. Med. Chem., 49, 2006
3TQ8
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STRUCTURE OF THE DIHYDROFOLATE REDUCTASE (FOLA) FROM COXIELLA BURNETII IN COMPLEX WITH TRIMETHOPRIM
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, TRIMETHOPRIM
Authors:Franklin, M.C., Cassidy, M., Hillerich, B., Love, J.
Deposit date:2011-09-09
Release date:2011-11-02
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQ9
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STRUCTURE OF THE DIHYDROFOLATE REDUCTASE (FOLA) FROM COXIELLA BURNETII IN COMPLEX WITH METHOTREXATE
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, METHOTREXATE
Authors:Franklin, M.C., Cassidy, M., Hillerich, B., Love, J.
Deposit date:2011-09-09
Release date:2011-11-02
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQA
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STRUCTURE OF THE DIHYDROFOLATE REDUCTASE (FOLA) FROM COXIELLA BURNETII IN COMPLEX WITH NADPH
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Franklin, M.C., Cassidy, M., Hillerich, B., Love, J.
Deposit date:2011-09-09
Release date:2011-11-02
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQB
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STRUCTURE OF THE DIHYDROFOLATE REDUCTASE (FOLA) FROM COXIELLA BURNETII IN COMPLEX WITH FOLATE
Descriptor:Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, FOLIC ACID
Authors:Franklin, M.C., Cassidy, M., Hillerich, B., Love, J.
Deposit date:2011-09-09
Release date:2011-11-02
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQC
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STRUCTURE OF THE PANTOTHENATE KINASE (COAA) FROM COXIELLA BURNETII
Descriptor:Pantothenate kinase, ADENOSINE-5'-DIPHOSPHATE
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-21
Last modified:2016-01-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQD
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STRUCTURE OF THE 3-DEOXY-D-MANNO-OCTULOSONATE CYTIDYLYLTRANSFERASE (KDSB) FROM COXIELLA BURNETII
Descriptor:3-deoxy-manno-octulosonate cytidylyltransferase, NICKEL (II) ION, ACETATE ION
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-10-26
Last modified:2016-02-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQE
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STRUCTURE OF THE MALONYL COA-ACYL CARRIER PROTEIN TRANSACYLASE (FABD) FROM COXIELLA BURNETII
Descriptor:Malonyl-CoA-[acyl-carrier-protein] transacylase, GLYCINE, 1,2-ETHANEDIOL
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-21
Last modified:2016-01-27
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQF
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STRUCTURE OF THE HPR(SER) KINASE/PHOSPHATASE FROM COXIELLA BURNETII
Descriptor:Hpr(Ser) kinase, PHOSPHATE ION
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-21
Last modified:2016-01-27
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQG
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STRUCTURE OF THE 2-METHYLCITRATE SYNTHASE (PRPC) FROM COXIELLA BURNETII
Descriptor:2-methylcitrate synthase
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-28
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQH
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STRUCTURE OF THE QUINONE OXIDOREDUCTASE FROM COXIELLA BURNETII
Descriptor:Quinone oxidoreductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, SULFATE ION
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-28
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.44 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQI
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STRUCTURE OF THE GMP SYNTHASE (GUAA) FROM COXIELLA BURNETII
Descriptor:GMP synthase [glutamine-hydrolyzing]
Authors:Franklin, M.C., Cheung, J., Rudolph, M., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-28
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.84 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQJ
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STRUCTURE OF THE SUPEROXIDE DISMUTASE (FE) (SODB) FROM COXIELLA BURNETII
Descriptor:Superoxide dismutase [Fe], FE (II) ION
Authors:Franklin, M.C., Cheung, J., Cassidy, M., Love, J.
Deposit date:2011-09-09
Release date:2011-09-21
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (2.004 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQL
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STRUCTURE OF THE AMINO ACID ABC TRANSPORTER, PERIPLASMIC AMINO ACID-BINDING PROTEIN FROM COXIELLA BURNETII.
Descriptor:Arginine-binding protein, ARGININE, IMIDAZOLE
Authors:Rudolph, M., Cheung, J., Franklin, M.C., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-10-05
Last modified:2016-01-20
Method:X-RAY DIFFRACTION (1.594 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
3TQM
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STRUCTURE OF AN RIBOSOMAL SUBUNIT INTERFACE PROTEIN FROM COXIELLA BURNETII
Descriptor:Ribosome-associated factor Y, SULFATE ION
Authors:Rudolph, M., Cheung, J., Franklin, M.C., Cassidy, M., Gary, E., Burshteyn, F., Love, J.
Deposit date:2011-09-09
Release date:2011-09-28
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Structural genomics for drug design against the pathogen Coxiella burnetii.
Proteins, 83, 2015
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