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7E6W
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BU of 7e6w by Molmil
Crystal structure of Sesquisabinene B Synthase 1 mutant G418A and F419N
Descriptor: Sesquisabinene B synthase 1
Authors:Singh, S, Thulasiram, H.V, Kulkarni, K.A.
Deposit date:2021-02-24
Release date:2022-03-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Crystal structure of Sesquisabinene B Synthase 1 mutant G418A and F419N
To Be Published
4DI5
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BU of 4di5 by Molmil
Co-crystal structure of WT 5-epi-Aristolochene synthase from Nicotiana tobaccum with geraniline
Descriptor: 5-epi-aristolochene synthase, ACETATE ION, DIPHOSPHATE, ...
Authors:Noel, J.P, Starks, C, Crenshaw, C.M.
Deposit date:2012-01-30
Release date:2012-02-29
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Co-crystal structure of WT 5-epi-Aristolochene synthase from Nicotiana tobaccum with geraniline
To be Published
7E9R
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BU of 7e9r by Molmil
Crystal structure of Sesquisabinene B Synthase 1 mutant T313S
Descriptor: MAGNESIUM ION, Sesquisabinene B synthase 1
Authors:Singh, S, Thulasiram, H.V, Kulkarni, K.A.
Deposit date:2021-03-04
Release date:2022-03-09
Last modified:2024-08-14
Method:X-RAY DIFFRACTION (3.41 Å)
Cite:Crystal structure of Sesquisabinene B Synthase 1 mutant T313S
To Be Published
4GAX
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BU of 4gax by Molmil
Crystal Structure of an alpha-Bisabolol synthase mutant
Descriptor: Amorpha-4,11-diene synthase
Authors:Li, J, Peng, Z.
Deposit date:2012-07-26
Release date:2013-03-13
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.9948 Å)
Cite:Rational engineering of plasticity residues of sesquiterpene synthases from Artemisia annua: product specificity and catalytic efficiency.
Biochem.J., 451, 2013
5UV1
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BU of 5uv1 by Molmil
Crystal Structure of (+)-Limonene Synthase Complexed with 2-Fluorogeranyl Diphosphate
Descriptor: (+)-limonene synthase, (2Z)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate, MANGANESE (II) ION
Authors:Prem Kumar, R, Malik, K, Oprian, D.D.
Deposit date:2017-02-17
Release date:2017-03-22
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural Characterization of Early Michaelis Complexes in the Reaction Catalyzed by (+)-Limonene Synthase from Citrus sinensis Using Fluorinated Substrate Analogues.
Biochemistry, 56, 2017
5UV2
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BU of 5uv2 by Molmil
Crystal Structure of (+)-Limonene Synthase Complexed with 2-Fluoroneryl Diphosphate
Descriptor: (+)-limonene synthase, (2E)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate, MANGANESE (II) ION
Authors:Prem Kumar, R, Malik, K, Oprian, D.D.
Deposit date:2017-02-17
Release date:2017-03-22
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural Characterization of Early Michaelis Complexes in the Reaction Catalyzed by (+)-Limonene Synthase from Citrus sinensis Using Fluorinated Substrate Analogues.
Biochemistry, 56, 2017
4FJQ
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BU of 4fjq by Molmil
Crystal Structure of an alpha-Bisabolol synthase
Descriptor: Amorpha-4,11-diene synthase
Authors:Jianxu, L, Peng, Z.
Deposit date:2012-06-12
Release date:2013-03-13
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.0001 Å)
Cite:Rational engineering of plasticity residues of sesquiterpene synthases from Artemisia annua: product specificity and catalytic efficiency.
Biochem.J., 451, 2013
5UV0
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BU of 5uv0 by Molmil
Crystal Structure of (+)-Limonene Synthase from Citrus sinensis
Descriptor: (+)-limonene synthase
Authors:Prem Kumar, R, Oprian, D.D.
Deposit date:2017-02-17
Release date:2017-03-22
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Functional and Structural Characterization of a (+)-Limonene Synthase from Citrus sinensis.
Biochemistry, 56, 2017
5C05
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BU of 5c05 by Molmil
Crystal Structure of Gamma-terpinene Synthase from Thymus vulgaris
Descriptor: 1,2-ETHANEDIOL, Putative gamma-terpinene synthase
Authors:Parthier, C.P, Rudolph, K, Muller, Y.A, Mueller-Uri, F.
Deposit date:2015-06-12
Release date:2016-01-13
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Expression, crystallization and structure elucidation of gamma-terpinene synthase from Thymus vulgaris.
Acta Crystallogr.,Sect.F, 72, 2016
3P5P
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BU of 3p5p by Molmil
Crystal Structure of Taxadiene Synthase from Pacific Yew (Taxus brevifolia) in complex with Mg2+ and 13-aza-13,14-dihydrocopalyl diphosphate
Descriptor: 1,2-ETHANEDIOL, 2-(methyl{2-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]ethyl}amino)ethyl trihydrogen diphosphate, MAGNESIUM ION, ...
Authors:Koksal, M, Christianson, D.W.
Deposit date:2010-10-10
Release date:2010-12-29
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.816 Å)
Cite:Taxadiene synthase structure and evolution of modular architecture in terpene biosynthesis.
Nature, 469, 2011
5DHI
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BU of 5dhi by Molmil
Nicotiana tabacum 5-epi-aristolochene synthase mutant W273E - nonalkylated
Descriptor: 5-epi-aristolochene synthase, MAGNESIUM ION
Authors:Noel, J.P, Kersten, R.D.
Deposit date:2015-08-31
Release date:2015-09-16
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Mechanism-Based Post-Translational Modification and Inactivation in Terpene Synthases.
Acs Chem.Biol., 10, 2015
5DHK
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BU of 5dhk by Molmil
Nicotiana tabacum 5-epi-aristolochene synthase mutant W273E - alkylated
Descriptor: 5-epi-aristolochene synthase, FARNESYL, MAGNESIUM ION
Authors:Noel, J.P, Kersten, R.K.
Deposit date:2015-08-31
Release date:2015-09-16
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.43 Å)
Cite:Mechanism-Based Post-Translational Modification and Inactivation in Terpene Synthases.
Acs Chem.Biol., 10, 2015
1HXA
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BU of 1hxa by Molmil
CRYSTAL STRUCTURE OF TEAS W273S FORM 2
Descriptor: 1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID, 5-EPI-ARISTOLOCHENE SYNTHASE, MAGNESIUM ION
Authors:Starks, C.S, Rising, K.A, Chappell, J, Noel, J.P.
Deposit date:2001-01-12
Release date:2003-06-24
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.32 Å)
Cite:Single Active Site Mutations Change the Specificity of a Sesquiterpene Cyclase
To be Published
1HX9
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BU of 1hx9 by Molmil
CRYSTAL STRUCTURE OF TEAS W273S FORM 1
Descriptor: 1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID, 5-EPI-ARISTOLOCHENE SYNTHASE, MAGNESIUM ION
Authors:Starks, C.S, Rising, K.A, Chappell, J, Noel, J.P.
Deposit date:2001-01-12
Release date:2003-06-24
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Single Active Site Mutations Change the Specificity of a Sesquiterpene Cyclase
To be Published
1HXG
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BU of 1hxg by Molmil
CRYSTAL STRUCTURE OF TEAS W273S/C440W
Descriptor: 5-EPI-ARISTOLOCHENE SYNTHASE, MAGNESIUM ION
Authors:Starks, C.S, Rising, K.A, Chappell, J, Noel, J.P.
Deposit date:2001-01-12
Release date:2003-06-24
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Single Active Site Mutations Change the Specificity of a Sesquiterpene Cyclase
To be Published
5IK6
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BU of 5ik6 by Molmil
Tobacco 5-epi-aristolochene synthase with germacrene A and PPi
Descriptor: 5-epi-aristolochene synthase, DIPHOSPHATE, GERMACRENE A, ...
Authors:Koo, H.J, Xu, Y, Louie, G.V, Bowman, M, Noel, J.P.
Deposit date:2016-03-03
Release date:2016-10-05
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Biosynthetic potential of sesquiterpene synthases: product profiles of Egyptian Henbane premnaspirodiene synthase and related mutants.
J.Antibiot., 69, 2016
5IL3
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BU of 5il3 by Molmil
Tobacco 5-epi-aristolochene synthase with MOPSO buffer molecule and Mg2+ ions
Descriptor: (2R)-2-hydroxy-3-(morpholin-4-yl)propane-1-sulfonic acid, (2S)-2-hydroxy-3-(morpholin-4-yl)propane-1-sulfonic acid, 5-epi-aristolochene synthase, ...
Authors:Koo, H.J, Louie, G.V, Xu, Y, Bowman, M, Noel, J.P.
Deposit date:2016-03-04
Release date:2017-03-08
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Small-molecule buffer components can directly affect terpene-synthase activity by interacting with the substrate-binding site of the enzyme
To Be Published
5ILH
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BU of 5ilh by Molmil
Tobacco 5-epi-aristolochene synthase with CAPSO buffer molecule and Ca2+ ions
Descriptor: (2R)-3-(cyclohexylamino)-2-hydroxypropane-1-sulfonic acid, (2S)-3-(cyclohexylamino)-2-hydroxypropane-1-sulfonic acid, 5-epi-aristolochene synthase, ...
Authors:Koo, H.J, Louie, G.V, Xu, Y, Bowman, M, Noel, J.P.
Deposit date:2016-03-04
Release date:2017-03-08
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Small-molecule buffer components can directly affect terpene-synthase activity by interacting with the substrate-binding site of the enzyme
To Be Published
5IKA
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BU of 5ika by Molmil
Tobacco 5-epi-aristolochene synthase with PPi
Descriptor: 5-epi-aristolochene synthase, DIPHOSPHATE, MAGNESIUM ION
Authors:Koo, H.J, Xu, Y, Louie, G.V, Bowman, M, Noel, J.P.
Deposit date:2016-03-03
Release date:2016-10-05
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Biosynthetic potential of sesquiterpene synthases: product profiles of Egyptian Henbane premnaspirodiene synthase and related mutants.
J.Antibiot., 69, 2016
5EAU
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BU of 5eau by Molmil
5-EPI-ARISTOLOCHENE SYNTHASE FROM NICOTIANA TABACUM
Descriptor: 5-EPI-ARISTOLOCHENE SYNTHASE, MAGNESIUM ION, TRIFLUOROFURNESYL DIPHOSPHATE
Authors:Starks, C.M, Back, K, Chappell, J, Noel, J.P.
Deposit date:1997-12-11
Release date:1998-04-08
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structural basis for cyclic terpene biosynthesis by tobacco 5-epi-aristolochene synthase.
Science, 277, 1997
1HXC
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BU of 1hxc by Molmil
CRYSTAL STRUCTURE OF TEAS C440W
Descriptor: 1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID, 5-EPI-ARISTOLOCHENE SYNTHASE
Authors:Starks, C.S, Rising, K.A, Chappell, J, Noel, J.P.
Deposit date:2001-01-12
Release date:2003-06-24
Last modified:2021-10-27
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Single Active Site Mutations Change the Specificity of a Sesquiterpene Cyclase
To be Published
3P5R
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BU of 3p5r by Molmil
Crystal Structure of Taxadiene Synthase from Pacific Yew (Taxus brevifolia) in complex with Mg2+ and 2-fluorogeranylgeranyl diphosphate
Descriptor: (2Z,6E,10E)-2-fluoro-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate, MAGNESIUM ION, Taxadiene synthase
Authors:Koksal, M, Christianson, D.W.
Deposit date:2010-10-10
Release date:2010-12-29
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.247 Å)
Cite:Taxadiene synthase structure and evolution of modular architecture in terpene biosynthesis.
Nature, 469, 2011
3LZ9
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BU of 3lz9 by Molmil
The Crystal Structure of 5-epi-aristolochene synthase M4 mutant complexed with (2-trans,6-trans)-2-fluorofarnesyl diphosphate
Descriptor: (2Z,6E)-2-fluoro-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate, Aristolochene synthase, MAGNESIUM ION
Authors:Noel, J.P, Dellas, N, Faraldos, J.A, Zhao, M, Hess Jr, B.A, Smentek, L, Coates, R.M, O'Maille, P.E.
Deposit date:2010-03-01
Release date:2010-04-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.28 Å)
Cite:Structural elucidation of cisoid and transoid cyclization pathways of a sesquiterpene synthase using 2-fluorofarnesyl diphosphates.
Acs Chem.Biol., 5, 2010
3M00
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BU of 3m00 by Molmil
Crystal Structure of 5-epi-aristolochene synthase M4 mutant complexed with (2-cis,6-trans)-2-fluorofarnesyl diphosphate
Descriptor: (2E,6E)-2-fluoro-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate, Aristolochene synthase, MAGNESIUM ION
Authors:Noel, J.P, Dellas, N, Faraldos, J.A, Zhao, M, Hess Jr, B.A, Smentek, L, Coates, R.M, O'Maille, P.E.
Deposit date:2010-03-02
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural elucidation of cisoid and transoid cyclization pathways of a sesquiterpene synthase using 2-fluorofarnesyl diphosphates.
Acs Chem.Biol., 5, 2010
3M02
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BU of 3m02 by Molmil
The Crystal Structure of 5-epi-aristolochene synthase complexed with (2-cis,6-trans)-2-fluorofarnesyl diphosphate
Descriptor: (2E,6E)-2-fluoro-3,7,11-trimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate, Aristolochene synthase, MAGNESIUM ION
Authors:Noel, J.P, Dellas, N, Faraldos, J.A, Zhao, M, Hess Jr, B.A, Smentek, L, Coates, R.M, O'Maille, P.E.
Deposit date:2010-03-02
Release date:2010-07-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural elucidation of cisoid and transoid cyclization pathways of a sesquiterpene synthase using 2-fluorofarnesyl diphosphates.
Acs Chem.Biol., 5, 2010

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