6CV6
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CRYSTAL STRUCTURE OF 3-DEHYDROQUINATE DEHYDRATASE, TYPE II, FROM BURKHOLDERIA PHYMATUM STM815
Descriptor:3-dehydroquinate dehydratase, L(+)-TARTARIC ACID, D(-)-TARTARIC ACID, ...
Authors:Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2018-03-27
Release date:2018-04-11
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structure of 3-dehydroquinate dehydratase, type II, from Burkholderia phymatum STM815
to be published
5YPQ
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CRYSTAL STRUCTURE OF SULFATED DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 2.65 A RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SULFATE ION, GLYCEROL
Authors:Iqbal, N., Kaur, P., Sharma, S., Singh, T.
Deposit date:2017-11-02
Release date:2017-11-22
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Crystal structure of sulfated dehydroquinate dehydratase from Acinetobacter baumannii at 2.65 A resolution
To Be Published
5YL5
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CRYSTAL STRUCTURE OF DODECAMERIC DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 1.9A RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SULFATE ION, GLYCEROL, ...
Authors:Iqbal, N., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2017-10-17
Release date:2017-11-01
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of dodecameric Dehydroquinate dehydratase from Acinetobacter baumannii at 1.9A resolution
To Be Published
5YHM
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CRYSTAL STRUCTURE OF DEHYDROQUINATE DEHYDRATASE WITH TRIS INDUCED OLIGOMERISATION AT 1.907 ANGSTROM RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SULFATE ION, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
Authors:Iqbal, N., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2017-09-28
Release date:2017-10-25
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:Crystal structure of dehydroquinate dehydratase with tris induced oligomerisation at 1.907 Angstrom resolution
To Be Published
5YDB
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CRYSTAL STRUCTURE OF THE COMPLEX OF TYPE II DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII WITH DEHYDROQUINIC ACID AT 1.76 ANGSTROM RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SODIUM ION, 1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACID
Authors:Iqbal, N., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2017-09-12
Release date:2017-09-20
Last modified:2018-07-11
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Crystal structure of the complex of type II dehydroquinate dehydratase from Acinetobacter baumannii with dehydroquinic acid at 1.76 Angstrom resolution
To Be Published
5X47
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CRYSTAL STRUCTURE OF DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 2.5 ANGSTROM RESOLUTION
Descriptor:3-dehydroquinate dehydratase
Authors:Iqbal, N., Singh, P.K., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2017-02-10
Release date:2017-03-01
Method:X-RAY DIFFRACTION (2.54 Å)
Cite:Crystal structure of dehydroquinate dehydratase from Acinetobacter baumannii at 2.5 Angstrom resolution
To Be Published
5WRF
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CRYSTAL STRUCTURE OF DODECAMERIC TYPE II DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII WITH UNEXPLAINED CONNECTING ELECTRON DENSITY BETWEEN FREE CYSTEINE RESIDUES OF MOLECULAR PAIRS
Descriptor:3-dehydroquinate dehydratase, 1,2-ETHANEDIOL
Authors:Iqbal, N., Singh, P.K., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2016-12-01
Release date:2016-12-21
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:Crystal structure of dodecameric type II dehydroquinate dehydratase from Acinetobacter baumannii with unexplained connecting electron density between free cysteine residues of molecular pairs
To Be Published
5B6P
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STRUCTURE OF THE DODECAMERIC TYPE-II DEHYDROGENATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 2.00 A RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SULFATE ION
Authors:Kumar, M., Iqbal, N., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2016-05-31
Release date:2016-09-07
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structure of the dodecameric type-II dehydrogenate dehydratase from Acinetobacter baumannii at 2.00 A resolution.
To Be Published
4ZC1
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CRYSTAL STRUCTURE OF TYPE II DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII WITH A DIFFERENT CRYSTAL FORM AT 2.52 A RESOLUTION
Descriptor:3-dehydroquinate dehydratase
Authors:Iqbal, N., Kumar, M., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2015-04-15
Release date:2015-05-20
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Crystal Structure of type II Dehydroquinate dehydratase from Acinetobacter baumannii with different crystal form at 2.52 A Resolution
To Be Published
4V0S
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CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE D88N MUTANT INHIBITED BY A 3-DEHYDROQUINIC ACID DERIVATIVE
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, (1R,2S,4S,5R)-2-(2,3,4,5,6-pentafluorophenyl)methyl-1,4,5-trihydroxy-3-oxocyclohexane-1-carboxylic acid, 3,4-DIHYDROXY-2-[(2,3,4,5,6-PENTAFLUOROPHENYL)METHYL]BENZOIC ACID, ...
Authors:Otero, J.M., Llamas-Saiz, A.L., Santiago, C., Lamb, H., Hawkins, A.R., Maneiro, M., Peon, A., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-09-18
Release date:2016-01-13
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4RHC
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CRYSTAL STRUCTURE OF 3-DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 2.68 A RESOLUTION
Descriptor:3-dehydroquinate dehydratase
Authors:Iqbal, N., Singh, A., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2014-10-01
Release date:2014-10-15
Method:X-RAY DIFFRACTION (2.68 Å)
Cite:Crystal structure of 3-Dehydroquinate dehydratase from Acinetobacter baumannii at 2.68 A resolution
TO BE PUBLISHED
4RC9
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CRYSTAL STRUCTURE OF THE TYPE II DEHYDROQUINATE DEHYDRATASE FROM ACINETOBACTER BAUMANNII AT 2.03A RESOLUTION
Descriptor:3-dehydroquinate dehydratase, SULFATE ION
Authors:Iqbal, N., Kumar, M., Kaur, P., Sharma, S., Singh, T.P.
Deposit date:2014-09-15
Release date:2014-10-29
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Crystal Structure of the type II Dehydroquinate dehydratase from Acinetobacter baumannii at 2.03 A Resolution
To be Published
4L8L
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CRYSTAL STRUCTURE OF THE TYPE II DEHYDROQUINASE FROM PSEUDOMONAS AERUGINOSA
Descriptor:3-dehydroquinate dehydratase 1
Authors:Reiling, S.A., Asojo, O.A.
Deposit date:2013-06-17
Release date:2014-07-23
Last modified:2014-11-19
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Structure of type II dehydroquinase from Pseudomonas aeruginosa.
Acta Crystallogr F Struct Biol Commun, 70, 2014
4KIW
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DESIGN AND STRUCTURAL ANALYSIS OF AROMATIC INHIBITORS OF TYPE II DEHYDROQUINATE DEHYDRATASE FROM MYCOBACTERIUM TUBERCULOSIS - COMPOUND 49E [5-[(3-NITROBENZYL)AMINO]BENZENE-1,3-DICARBOXYLIC ACID]
Descriptor:3-dehydroquinate dehydratase, 5-[(3-nitrobenzyl)amino]benzene-1,3-dicarboxylic acid
Authors:Dias, M.V.B., Howard, N.G., Blundell, T.L., Abell, C.
Deposit date:2013-05-02
Release date:2014-05-14
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.57 Å)
Cite:Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis.
Chemmedchem, 10, 2015
4KIU
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DESIGN AND STRUCTURAL ANALYSIS OF AROMATIC INHIBITORS OF TYPE II DEHYDROQUINATE DEHYDRATASE FROM MYCOBACTERIUM TUBERCULOSIS - COMPOUND 49D [5-[(3-NITROBENZYL)OXY]BENZENE-1,3-DICARBOXYLIC ACID]
Descriptor:3-dehydroquinate dehydratase, 5-[(3-nitrobenzyl)oxy]benzene-1,3-dicarboxylic acid
Authors:Dias, M.V.B., Howard, N.G., Blundell, T.L., Abell, C.
Deposit date:2013-05-02
Release date:2014-05-14
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis.
Chemmedchem, 10, 2015
4KIJ
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DESIGN AND STRUCTURAL ANALYSIS OF AROMATIC INHIBITORS OF TYPE II DEHYDROQUINASE DEHYDRATASE FROM MYCOBACTERIUM TUBERCULOSIS - COMPOUND 35C [3,4-DIHYDROXY-5-(3-NITROPHENOXY)BENZOIC ACID]
Descriptor:3-dehydroquinate dehydratase, CHLORIDE ION, 3,4-dihydroxy-5-(3-nitrophenoxy)benzoic acid
Authors:Dias, M.V.B., Howard, N.G., Blundell, T.L., Abell, C.
Deposit date:2013-05-02
Release date:2014-05-14
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis.
Chemmedchem, 10, 2015
4KI7
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DESIGN AND STRUCTURAL ANALYSIS OF AROMATIC INHIBITORS OF TYPE II DEHYDROQUINASE FROM MYCOBACTERIUM TUBERCULOSIS - COMPOUND 41C [3-HYDROXY-5-(3-NITROPHENOXY)BENZOIC ACID]
Descriptor:3-dehydroquinate dehydratase, 3-hydroxy-5-(3-nitrophenoxy)benzoic acid
Authors:Dias, M.V.B., Howard, N.G., Blundell, T.L., Abell, C.
Deposit date:2013-05-01
Release date:2014-05-14
Last modified:2015-01-07
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis.
Chemmedchem, 10, 2015
4CL0
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STRUCTURE OF THE MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE INHIBITED BY A 3-DEHYDROQUINIC ACID DERIVATIVE
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, (2R)-2-METHYL-3-DEHYDROQUINIC ACID
Authors:Otero, J.M., Llamas-Saiz, A.L., Maneiro, M., Peon, A., Sedes, A., Lamb, H., Hawkins, A.R., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-01-10
Release date:2015-03-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4CKZ
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STRUCTURE OF THE MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE D88N MUTANT
Descriptor:3-DEHYDROQUINATE DEHYDRATASE
Authors:Otero, J.M., Llamas-Saiz, A.L., Maneiro, M., Peon, A., Sedes, A., Lamb, H., Hawkins, A.R., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-01-10
Release date:2015-03-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4CKY
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STRUCTURE OF THE MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE INHIBITED BY A 3-DEHYDROQUINIC ACID DERIVATIVE
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, SODIUM ION, SULFATE ION, ...
Authors:Otero, J.M., Llamas-Saiz, A.L., Maneiro, M., Peon, A., Sedes, A., Lamb, H., Hawkins, A.R., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-01-10
Release date:2015-03-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4CKX
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STRUCTURE OF THE MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE N12S MUTANT (CRYSTAL FORM 2)
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
Authors:Otero, J.M., Llamas-Saiz, A.L., Maneiro, M., Peon, A., Sedes, A., Lamb, H., Hawkins, A.R., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-01-10
Release date:2015-03-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4CKW
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STRUCTURE OF THE MYCOBACTERIUM TUBERCULOSIS TYPE II DEHYDROQUINASE N12S MUTANT (CRYSTAL FORM 1)
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, GLYCEROL
Authors:Otero, J.M., Llamas-Saiz, A.L., Maneiro, M., Peon, A., Sedes, A., Lamb, H., Hawkins, A.R., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2014-01-10
Release date:2015-03-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Investigation of the Dehydratation Mechanism Catalyzed by the Type II Dehydroquinase
To be Published
4CIY
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CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS TYPE 2 DEHYDROQUINASE IN COMPLEX WITH (1R,4R,5R)-1,4,5-TRIHYDROXY-3-((1R)-1-HYDROXY-2- PHENYL)ETHYLCYCLOHEX-2-EN-1-CARBOXYLIC ACID
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, (1R,4R,5R)-1,4,5-trihydroxy-3-[(1R)-1-hydroxy-2-phenyl]ethylcyclohex-2-ene-1-carboxylic acid, SULFATE ION, ...
Authors:Otero, J.M., Llamas-Saiz, A.L., Lamb, H., Hawkins, A.R., Blanco, B., Sedes, A., Peon, A., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2013-12-17
Release date:2014-04-16
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Exploring the water-binding pocket of the type II dehydroquinase enzyme in the structure-based design of inhibitors.
J. Med. Chem., 57, 2014
4CIX
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CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS TYPE 2 DEHYDROQUINASE IN COMPLEX WITH(1R,4R,5R)-1,4,5-TRIHYDROXY-3-((1S)-1-HYDROXY-2-PHENYL) ETHYLCYCLOHEX-2-EN-1-CARBOXYLIC ACID
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, (1R,4R,5R)-1,4,5-trihydroxy-3-[(1S)-1-hydroxy-2-phenyl]ethylcyclohex-2-ene-1-carboxylic acid, SULFATE ION
Authors:Otero, J.M., Llamas-Saiz, A.L., Lamb, H., Hawkins, A.R., Blanco, B., Sedes, A., Peon, A., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2013-12-17
Release date:2014-04-16
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Exploring the water-binding pocket of the type II dehydroquinase enzyme in the structure-based design of inhibitors.
J. Med. Chem., 57, 2014
4CIW
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CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS TYPE 2 DEHYDROQUINASE IN COMPLEX WITH (1R,4R,5R)-1,4,5-TRIHYDROXY-3-(2-HYDROXY)ETHYLCYCLOHEX-2-ENE-1-CARBOXYLIC ACID
Descriptor:3-DEHYDROQUINATE DEHYDRATASE, SULFATE ION, SODIUM ION, ...
Authors:Otero, J.M., Llamas-Saiz, A.L., Lamb, H., Hawkins, A.R., Blanco, B., Sedes, A., Peon, A., Gonzalez-Bello, C., van Raaij, M.J.
Deposit date:2013-12-17
Release date:2014-04-16
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Exploring the water-binding pocket of the type II dehydroquinase enzyme in the structure-based design of inhibitors.
J. Med. Chem., 57, 2014
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