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4JUF
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BU of 4juf by Molmil
Crystal Structure of His281Ala mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: Benzoylformate decarboxylase, CALCIUM ION, GLYCEROL, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-05-01
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.148 Å)
主引用文献Crystal Structure of His281Ala mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JUB
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BU of 4jub by Molmil
Crystal Structure of the His70Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: Benzoylformate decarboxylase, CALCIUM ION, GLYCEROL, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-05-08
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.901 Å)
主引用文献Crystal Structure of the His70Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JU9
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BU of 4ju9 by Molmil
Crystal Structure of the His70Leu mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-04-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.124 Å)
主引用文献Crystal Structure of the His70Leu mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JUD
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BU of 4jud by Molmil
Crystal Structure of the Ser26Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-04-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Crystal Structure of the Ser26Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JU8
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BU of 4ju8 by Molmil
Crystal Structure of the His70Phe mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-04-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.251 Å)
主引用文献Crystal Structure of the His70Phe mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JUC
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BU of 4juc by Molmil
Crystal Structure of the Ser26Met mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: Benzoylformate decarboxylase, CALCIUM ION, GLYCEROL, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-04-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.303 Å)
主引用文献Crystal Structure of the Ser26Met mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
4JUA
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BU of 4jua by Molmil
Crystal Structure of the His70Ser mutant of Benzoylformate Decarboxylase from Pseudomonas putida
分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ...
著者McLeish, M.J, Brodkin, H.R.
登録日2013-03-24
公開日2013-04-17
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Crystal Structure of the His70Ser mutant of Benzoylformate Decarboxylase from Pseudomonas putida
To be Published
1BFD
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BU of 1bfd by Molmil
BENZOYLFORMATE DECARBOXYLASE FROM PSEUDOMONAS PUTIDA
分子名称: BENZOYLFORMATE DECARBOXYLASE, CALCIUM ION, MAGNESIUM ION, ...
著者Hasson, M.S, Muscate, A, Mcleish, M.J, Polovnikova, L.S, Gerlt, J.A, Kenyon, G.L, Petsko, G.A, Ringe, D.
登録日1998-04-30
公開日1998-06-24
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The crystal structure of benzoylformate decarboxylase at 1.6 A resolution: diversity of catalytic residues in thiamin diphosphate-dependent enzymes.
Biochemistry, 37, 1998
4QEL
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BU of 4qel by Molmil
Crystal Structure of Benzoylformate Decarboxylase Mutant H70A
分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ...
著者Andrews, F.H, Rogers, M.P, Brodkin, H.R, McLeish, M.J.
登録日2014-05-16
公開日2015-05-20
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.432 Å)
主引用文献Structural investigation of benzoylformate decarboxylase active site variants
To be Published
1VRP
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BU of 1vrp by Molmil
The 2.1 Structure of T. californica Creatine Kinase Complexed with the Transition-State Analogue Complex, ADP-Mg 2+ /NO3-/Creatine
分子名称: (DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACID, ADENOSINE-5'-DIPHOSPHATE, Creatine Kinase, ...
著者Lahiri, S.D, Wang, P.F, Babbitt, P.C, McLeish, M.J, Kenyon, G.L, Allen, K.N.
登録日2005-04-25
公開日2005-05-03
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献The 2.1 A Structure of Torpedo californica Creatine Kinase Complexed with the ADP-Mg(2+)-NO3(-)-Creatine Transition-State Analogue Complex
Biochemistry, 41, 2002
1HNN
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BU of 1hnn by Molmil
CRYSTAL STRUCTURE OF HUMAN PNMT COMPLEXED WITH SK&F 29661 AND ADOHCY(SAH)
分子名称: 1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE, PHENYLETHANOLAMINE N-METHYLTRANSFERASE, S-ADENOSYL-L-HOMOCYSTEINE
著者Martin, J.L, Begun, J, McLeish, M.J, Caine, J.M, Grunewald, G.L.
登録日2000-12-07
公開日2001-12-07
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Getting the adrenaline going: crystal structure of the adrenaline-synthesizing enzyme PNMT.
Structure, 9, 2001
1DJF
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BU of 1djf by Molmil
NMR STRUCTURE OF A MODEL HYDROPHILIC AMPHIPATHIC HELICAL BASIC PEPTIDE
分子名称: GLN-ALA-PRO-ALA-TYR-LYS-LYS-ALA-ALA-LYS-LYS-LEU-ALA-GLU-SER
著者Montserret, R, McLeish, M.J, Bockmann, A, Geourjon, C, Penin, F.
登録日1999-12-03
公開日1999-12-10
最終更新日2022-02-16
実験手法SOLUTION NMR
主引用文献Involvement of electrostatic interactions in the mechanism of peptide folding induced by sodium dodecyl sulfate binding.
Biochemistry, 39, 2000
1DNG
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BU of 1dng by Molmil
NMR STRUCTURE OF A MODEL HYDROPHILIC AMPHIPATHIC HELICAL ACIDIC PEPTIDE
分子名称: HUMAN PLATELET FACTOR 4, SEGMENT 59-73
著者montserret, R, McLeish, M.J, Bockmann, A, Geourjon, C, Penin, F.
登録日1999-12-16
公開日2000-01-12
最終更新日2024-04-10
実験手法SOLUTION NMR
主引用文献Involvement of electrostatic interactions in the mechanism of peptide folding induced by sodium dodecyl sulfate binding.
Biochemistry, 39, 2000
1DN3
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BU of 1dn3 by Molmil
NMR STRUCTURE OF A MODEL HYDROPHILIC AMPHIPATHIC HELICAL BASIC PEPTIDE
分子名称: HUMAN PLATELET FACTOR 4, SEGMENT 59-73
著者Montserret, R, McLeish, M.J, Bockmann, A, Geourjon, C, Penin, F.
登録日1999-12-16
公開日2000-01-12
最終更新日2024-04-10
実験手法SOLUTION NMR
主引用文献Involvement of electrostatic interactions in the mechanism of peptide folding induced by sodium dodecyl sulfate binding.
Biochemistry, 39, 2000
4D5E
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BU of 4d5e by Molmil
Crystal Structure of recombinant wildtype CDH
分子名称: 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, ...
著者Loschonsky, S, Wacker, T, Waltzer, S, Giovannini, P.P, McLeish, M.J, Andrade, S.L.A, Mueller, M.
登録日2014-11-03
公開日2015-01-21
最終更新日2017-08-23
実験手法X-RAY DIFFRACTION (1.43 Å)
主引用文献Extended Reaction Scope of Thiamine Diphosphate Dependent Cyclohexane-1,2-Dione Hydrolase: From C-C Bond Cleavage to C-C Bond Ligation.
Angew.Chem.Int.Ed.Engl., 53, 2014
4D5G
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BU of 4d5g by Molmil
Structure of recombinant CDH-H28AN484A
分子名称: 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, CYCLOHEXANE-1,2-DIONE HYDROLASE, DI(HYDROXYETHYL)ETHER, ...
著者Loschonsky, S, Wacker, T, Waltzer, S, Giovannini, P.P, McLeish, M.J, Andrade, S.L.A, Mueller, M.
登録日2014-11-04
公開日2015-01-21
最終更新日2015-05-06
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Extended Reaction Scope of Thiamine Diphosphate Dependent Cyclohexane-1,2-Dione Hydrolase: From C-C Bond Cleavage to C-C Bond Ligation.
Angew.Chem.Int.Ed.Engl., 53, 2014
3F6E
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Crystal structure of benzoylformate decarboxylase in complex with the pyridyl inhibitor 3-PKB
分子名称: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-2-[(1S,2E)-1-hydroxy-3-pyridin-3-ylprop-2-en-1-yl]-4-methyl-1,3-thiazol-3-ium, Benzoylformate decarboxylase, MAGNESIUM ION
著者Brandt, G.S, McLeish, M.J, Kenyon, G.L, Petsko, G.A, Ringe, D, Jordan, F.
登録日2008-11-05
公開日2008-12-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Detection and time course of formation of major thiamin diphosphate-bound covalent intermediates derived from a chromophoric substrate analogue on benzoylformate decarboxylase.
Biochemistry, 48, 2009
3F6B
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Crystal structure of benzoylformate decarboxylase in complex with the pyridyl inhibitor PAA
分子名称: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-2-[(1S,2E)-1-hydroxy-3-pyridin-3-ylprop-2-en-1-yl]-4-methyl-1,3-thiazol-3-ium, Benzoylformate decarboxylase, MAGNESIUM ION
著者Brandt, G.S, McLeish, M.J, Kenyon, G.L, Petsko, G.A, Ringe, D, Jordan, F.
登録日2008-11-05
公開日2008-12-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Detection and time course of formation of major thiamin diphosphate-bound covalent intermediates derived from a chromophoric substrate analogue on benzoylformate decarboxylase.
Biochemistry, 48, 2009
3FSJ
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Crystal structure of benzoylformate decarboxylase in complex with the inhibitor MBP
分子名称: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-{(S)-hydroxy[(R)-hydroxy(methoxy)phosphoryl]phenylmethyl}-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium, Benzoylformate decarboxylase, CALCIUM ION
著者Brandt, G.S, Kenyon, G.L, McLeish, M.J, Jordan, F, Petsko, G.A, Ringe, D.
登録日2009-01-09
公開日2009-01-27
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Snapshot of a reaction intermediate: analysis of benzoylformate decarboxylase in complex with a benzoylphosphonate inhibitor.
Biochemistry, 48, 2009
5D6R
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Acetolactate Synthase from Klebsiella pneumoniae in Complex with Mechanism-Based Inhibitor
分子名称: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-[(Z)-2-fluoro-1-hydroxy-2-phosphonoethenyl]-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium, Acetolactate synthase, catabolic, ...
著者Latta, A.J, Andrews, F.H, McLeish, M.J.
登録日2015-08-12
公開日2016-07-20
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.276 Å)
主引用文献Acetolactate Synthase from Klebsiella pneumoniae in Complex with Mechanism-Based Inhibitor
To Be Published
5DX6
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Acetolactate Synthase from Klebsiella pneumoniae soaked with beta-fluoropyruvate
分子名称: 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-[(1R)-2-fluoro-1-hydroxyethyl]-5-(2-{[(S)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium, 3-fluoro-2-oxopropanoic acid, Acetolactate synthase, ...
著者Latta, A.J, McLeish, M.J, Andrews, F.H.
登録日2015-09-23
公開日2016-09-28
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Characterization of Acetolactate Synthase from Klebsiella pneumoniae
To Be Published
1YZ3
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Structure of human pnmt complexed with cofactor product adohcy and inhibitor SK&F 64139
分子名称: 7,8-DICHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE, Phenylethanolamine N-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
著者Wu, Q, Gee, C.L, Lin, F, Martin, J.L, Grunewald, G.L, McLeish, M.J.
登録日2005-02-27
公開日2006-02-07
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural, mutagenic, and kinetic analysis of the binding of substrates and inhibitors of human phenylethanolamine N-methyltransferase
J.Med.Chem., 48, 2005
2AN5
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Structure of human PNMT complexed with S-adenosyl-homocysteine and an inhibitor, trans-(1S,2S)-2-amino-1-tetralol
分子名称: PHOSPHATE ION, Phenylethanolamine N-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE, ...
著者Gee, C.L, Tyndall, J.D.A, Grunewald, G.L, Wu, Q, McLeish, M.J, Martin, J.L.
登録日2005-08-11
公開日2006-03-14
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Mode of binding of methyl acceptor substrates to the adrenaline-synthesizing enzyme phenylethanolamine N-methyltransferase: implications for catalysis
Biochemistry, 44, 2005
2AN3
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Structure of PNMT with S-adenosyl-L-homocysteine and the semi-rigid analogue acceptor substrate cis-(1R,2S)-2-amino-1-tetralol.
分子名称: CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN-1-OL, Phenylethanolamine N-methyltransferase, S-ADENOSYL-L-HOMOCYSTEINE
著者Gee, C.L, Tyndall, J.D.A, Grunewald, G.L, Wu, Q, McLeish, M.J, Martin, J.L.
登録日2005-08-11
公開日2006-03-14
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Mode of binding of methyl acceptor substrates to the adrenaline-synthesizing enzyme phenylethanolamine N-methyltransferase: implications for catalysis
Biochemistry, 44, 2005
2AN4
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Structure of PNMT complexed with S-adenosyl-L-homocysteine and the acceptor substrate octopamine
分子名称: 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL, PHOSPHATE ION, Phenylethanolamine N-methyltransferase, ...
著者Gee, C.L, Tyndall, J.D.A, Grunewald, G.L, Wu, Q, McLeish, M.J, Martin, J.L.
登録日2005-08-11
公開日2006-03-14
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Mode of binding of methyl acceptor substrates to the adrenaline-synthesizing enzyme phenylethanolamine N-methyltransferase: implications for catalysis
Biochemistry, 44, 2005

 

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