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2F9A
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BU of 2f9a by Molmil
HMG-CoA synthase from Brassica juncea in complex with F-244
Descriptor: (7R,12R,13R)-13-formyl-12,14-dihydroxy-3,5,7-trimethyltetradeca-2,4-dienoic acid, 3-Hydroxy-3-methylglutaryl coenzyme A synthase 1
Authors:Pojer, F, Ferrer, J.L, Richard, S.B, Noel, J.P.
Deposit date:2005-12-05
Release date:2006-07-25
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:Structural basis for the design of potent and species-specific inhibitors of 3-hydroxy-3-methylglutaryl CoA synthases.
Proc.Natl.Acad.Sci.Usa, 103, 2006
2FA3
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BU of 2fa3 by Molmil
HMG-CoA synthase from Brassica juncea in complex with acetyl-CoA and acetyl-cys117.
Descriptor: ACETYL COENZYME *A, HMG-CoA synthase
Authors:Pojer, F, Ferrer, J.L, Richard, S.B, Noel, J.P.
Deposit date:2005-12-06
Release date:2006-07-25
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.52 Å)
Cite:Structural basis for the design of potent and species-specific inhibitors of 3-hydroxy-3-methylglutaryl CoA synthases.
Proc.Natl.Acad.Sci.Usa, 103, 2006
2GHQ
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BU of 2ghq by Molmil
CTD-specific phosphatase Scp1 in complex with peptide C-terminal domain of RNA polymerase II
Descriptor: Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1, DNA-directed RNA polymerase II largest subunit, MAGNESIUM ION
Authors:Zhang, Y, Noel, J.P.
Deposit date:2006-03-27
Release date:2006-12-05
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Determinants for dephosphorylation of the RNA polymerase II C-terminal domain by Scp1.
Mol.Cell, 24, 2006
2GHT
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BU of 2ght by Molmil
CTD-specific phosphatase Scp1 in complex with peptide from C-terminal domain of RNA polymerase II
Descriptor: Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1, DNA-directed RNA polymerase II largest subunit, MAGNESIUM ION
Authors:Zhang, Y, Noel, J.P.
Deposit date:2006-03-27
Release date:2006-12-05
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Determinants for dephosphorylation of the RNA polymerase II C-terminal domain by Scp1.
Mol.Cell, 24, 2006
2H84
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BU of 2h84 by Molmil
Crystal Structure of the C-terminal Type III Polyketide Synthase (PKS III) Domain of 'Steely1' (a Type I/III PKS Hybrid from Dictyostelium)
Descriptor: HEXAETHYLENE GLYCOL, Steely1
Authors:Austin, M.B, Saito, T, Bowman, M.E, Haydock, S, Kato, A, Moore, B.S, Kay, R.R, Noel, J.P.
Deposit date:2006-06-06
Release date:2006-08-22
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Biosynthesis of Dictyostelium discoideum differentiation-inducing factor by a hybrid type I fatty acid-type III polyketide synthase.
Nat.Chem.Biol., 2, 2006
3P9K
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BU of 3p9k by Molmil
Crystal structure of perennial ryegrass LpOMT1 complexed with S-adenosyl-L-homocysteine and coniferaldehyde
Descriptor: (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal, Caffeic acid O-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
Authors:Louie, G.V, Noel, J.P, Bowman, M.E.
Deposit date:2010-10-17
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structure-Function Analyses of a Caffeic Acid O-Methyltransferase from Perennial Ryegrass Reveal the Molecular Basis for Substrate Preference.
Plant Cell, 22, 2010
3P9C
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BU of 3p9c by Molmil
Crystal structure of perennial ryegrass LpOMT1 bound to SAH
Descriptor: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, 1,2-ETHANEDIOL, ACETATE ION, ...
Authors:Louie, G.V, Noel, J.P, Bowman, M.E.
Deposit date:2010-10-17
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structure-Function Analyses of a Caffeic Acid O-Methyltransferase from Perennial Ryegrass Reveal the Molecular Basis for Substrate Preference.
Plant Cell, 22, 2010
3K52
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BU of 3k52 by Molmil
Crystal Structure of Isopentenyl Phosphate Kinase from M. jannaschii in complex with IP
Descriptor: Isopentenyl phosphate, SULFATE ION, isopentenyl phosphate kinase
Authors:Dellas, N, Noel, J.P.
Deposit date:2009-10-06
Release date:2010-05-05
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Mutation of archaeal isopentenyl phosphate kinase highlights mechanism and guides phosphorylation of additional isoprenoid monophosphates.
Acs Chem.Biol., 5, 2010
3P9I
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BU of 3p9i by Molmil
Crystal structure of perennial ryegrass LpOMT1 complexed with S-adenosyl-L-homocysteine and sinapaldehyde
Descriptor: (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enal, BETA-MERCAPTOETHANOL, Caffeic acid O-methyltransferase, ...
Authors:Louie, G.V, Noel, J.P, Bowman, M.E.
Deposit date:2010-10-17
Release date:2011-01-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure-Function Analyses of a Caffeic Acid O-Methyltransferase from Perennial Ryegrass Reveal the Molecular Basis for Substrate Preference.
Plant Cell, 22, 2010
3K4Y
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BU of 3k4y by Molmil
Crystal Structure of Isopentenyl Phosphate Kinase from M. jannaschii in complex with IPP
Descriptor: 3-METHYLBUT-3-ENYL TRIHYDROGEN DIPHOSPHATE, SULFATE ION, isopentenyl phosphate kinase
Authors:Dellas, N, Noel, J.P.
Deposit date:2009-10-06
Release date:2010-05-05
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.54 Å)
Cite:Mutation of archaeal isopentenyl phosphate kinase highlights mechanism and guides phosphorylation of additional isoprenoid monophosphates.
Acs Chem.Biol., 5, 2010
3K56
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BU of 3k56 by Molmil
Crystal Structure of Isopentenyl Phosphate Kinase from M. jannaschii in complex with IPP beta-S
Descriptor: Isopentenyl Diphosphate Beta-S, SULFATE ION, isopentenyl phosphate kinase
Authors:Dellas, N, Noel, J.P.
Deposit date:2009-10-06
Release date:2010-05-05
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:Mutation of archaeal isopentenyl phosphate kinase highlights mechanism and guides phosphorylation of additional isoprenoid monophosphates.
Acs Chem.Biol., 5, 2010
3K4O
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BU of 3k4o by Molmil
Crystal Structure of Isopentenyl Phosphate Kinase from Methanocaldococcus jannaschii
Descriptor: MERCURY (II) ION, SULFATE ION, isopentenyl phosphate kinase
Authors:Dellas, N, Noel, J.P.
Deposit date:2009-10-05
Release date:2010-05-05
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Mutation of archaeal isopentenyl phosphate kinase highlights mechanism and guides phosphorylation of additional isoprenoid monophosphates.
Acs Chem.Biol., 5, 2010
3QTC
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BU of 3qtc by Molmil
Crystal structure of the catalytic domain of MmOmeRS, an O-methyl tyrosyl-tRNA synthetase evolved from Methanosarcina mazei PylRS, complexed with O-methyl tyrosine and AMP-PNP
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, O-methyl-L-tyrosine, ...
Authors:Dellas, N, Takimoto, J.K, Noel, J.P, Wang, L.
Deposit date:2011-02-22
Release date:2011-05-25
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Stereochemical Basis for Engineered Pyrrolysyl-tRNA Synthetase and the Efficient in Vivo Incorporation of Structurally Divergent Non-native Amino Acids.
Acs Chem.Biol., 6, 2011
3STU
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BU of 3stu by Molmil
Crystal Structure of tomato Methylketone Synthase I complexed with methyl-3-hydroxydodecanoate
Descriptor: DECANOIC ACID, Methylketone synthase 1, methyl (3S)-3-hydroxydodecanoate
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
3STT
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BU of 3stt by Molmil
Crystal Structure of tomato Methylketone Synthase I Apo form
Descriptor: DECANOIC ACID, Methylketone synthase I
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
3STV
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BU of 3stv by Molmil
Crystal Structure of tomato Methylketone Synthase I complexed with 3-hydroxyoctanoate
Descriptor: (3S)-3-hydroxyoctanoic acid, BROMIDE ION, Methylketone synthase 1
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
3STW
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BU of 3stw by Molmil
Crystal Structure of tomato Methylketone Synthase I complexed with 2-tridecanone
Descriptor: Methylketone synthase 1, tridec-12-en-2-one
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
3STX
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BU of 3stx by Molmil
Crystal Structure of tomato Methylketone Synthase I H243A variant complexed with beta-ketoheptanoate
Descriptor: 3-oxoheptanoic acid, Methylketone synthase 1
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
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
3STY
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BU of 3sty by Molmil
Crystal Structure of tomato Methylketone Synthase I T18A mutant
Descriptor: DECANOIC ACID, Methylketone synthase 1
Authors:Auldridge, M.E, Austin, M.B, Noel, J.P.
Deposit date:2011-07-11
Release date:2012-05-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Emergent Decarboxylase Activity and Attenuation of alpha/beta-Hydrolase Activity during the Evolution of Methylketone Biosynthesis in Tomato.
Plant Cell, 24, 2012
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
5ILK
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BU of 5ilk by Molmil
Tobacco 5-epi-aristolochene synthase with partial density from MOPSO or BIS-TRIS buffer molecule in the active site
Descriptor: 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 (2.35 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
5ILY
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BU of 5ily by Molmil
Tobacco 5-epi-aristolochene synthase with BIS-TRIS buffer molecule and diphosphate (PPi)
Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 5-epi-aristolochene synthase, DIPHOSPHATE, ...
Authors:Koo, H.J, Louie, G.V, Xu, Y, Bowman, M, Noel, J.P.
Deposit date:2016-03-05
Release date:2017-03-08
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.45 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

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