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4KZF
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BU of 4kzf by Molmil
The mechanism of the amidases: The effect of the mutation E142L in the amidase from Geobacillus pallidus
分子名称: Aliphatic amidase, CHLORIDE ION
著者Weber, B.W, Sewell, B.T, Kimani, S.W, Varsani, A, Cowan, D.A, Hunter, R.
登録日2013-05-29
公開日2013-08-21
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献The mechanism of the amidases: mutating the glutamate adjacent to the catalytic triad inactivates the enzyme due to substrate mispositioning.
J.Biol.Chem., 288, 2013
4LF0
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BU of 4lf0 by Molmil
The E142D mutant of the amidase from Geobacillus pallidus
分子名称: Aliphatic amidase
著者Sewell, B.T, Weber, B.W, Kimani, S.W, Cowan, D.A, Hunter, R, Venter, G.A, Gumbart, J.C, Thuku, R.N, Varsani, A.
登録日2013-06-26
公開日2013-08-21
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献The mechanism of the amidases: mutating the glutamate adjacent to the catalytic triad inactivates the enzyme due to substrate mispositioning.
J.Biol.Chem., 288, 2013
4GYN
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BU of 4gyn by Molmil
The E142L mutant of the amidase from Geobacillus pallidus
分子名称: Aliphatic amidase, CHLORIDE ION
著者Weber, B.W, Sewell, B.T, Kimani, S.W, Varsani, A, Cowan, D.A, Hunter, R.
登録日2012-09-05
公開日2013-08-21
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献The mechanism of the amidases: mutating the glutamate adjacent to the catalytic triad inactivates the enzyme due to substrate mispositioning.
J.Biol.Chem., 288, 2013
4GYL
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BU of 4gyl by Molmil
The E142L mutant of the amidase from Geobacillus pallidus showing the result of Michael addition of acrylamide at the active site cysteine
分子名称: Aliphatic amidase, CHLORIDE ION, PROPIONAMIDE
著者Weber, B.W, Sewell, B.T, Kimani, S.W, Varsani, A, Cowan, D.A, Hunter, R.
登録日2012-09-05
公開日2013-08-21
最終更新日2014-02-05
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献The mechanism of the amidases: mutating the glutamate adjacent to the catalytic triad inactivates the enzyme due to substrate mispositioning.
J.Biol.Chem., 288, 2013
4IZV
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BU of 4izv by Molmil
The E41Q/C145A double mutant of the amidase from Nesterenkonia sp. AN1 in complex with acrylamide
分子名称: Amidase, PROPIONAMIDE, prop-2-enamide
著者Kimani, S.W, Sewell, B.T.
登録日2013-01-30
公開日2014-02-12
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Covalent modifications of the active site cysteine occur as a result of mutating the glutamate of the catalytic triad in the amidase from Nesterenkonia sp.
To be Published
4IZS
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BU of 4izs by Molmil
The C145A mutant of the amidase from Nesterenkonia sp. AN1 in complex with butyramide
分子名称: Amidase, BUTYRAMIDE, DI(HYDROXYETHYL)ETHER
著者Kimani, S.W, Sewell, B.T.
登録日2013-01-30
公開日2014-02-12
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.44 Å)
主引用文献Covalent modifications of the active site cysteine occur as a result of mutating the glutamate of the catalytic triad in the amidase from Nesterenkonia sp.
To be Published
4IZT
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BU of 4izt by Molmil
The E41Q mutant of the amidase from Nesterenkonia sp. AN1 showing covalent addition of the acetamide moiety of fluoroacetamide at the active site cysteine
分子名称: 2-fluoroacetamide, ACETAMIDE, Amidase
著者Kimani, S.W, Sewell, B.T.
登録日2013-01-30
公開日2014-02-12
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Covalent modifications of the active site cysteine occur as a result of mutating the glutamate of the catalytic triad in the amidase from Nesterenkonia sp.
To be Published
7OVG
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BU of 7ovg by Molmil
The C146A variant of an amidase from Pyrococcus horikoshii with bound acetamide
分子名称: ACETAMIDE, CHLORIDE ION, CN hydrolase domain-containing protein
著者Su, S, Makumire, S, Sewell, B.T.
登録日2021-06-14
公開日2021-07-21
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献The structures of the C146A variant of the amidase from Pyrococcus horikoshii bound to glutaramide and acetamide suggest the basis of amide recognition.
J.Struct.Biol., 214, 2022
3FRZ
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BU of 3frz by Molmil
Crystal Structure of HCV NS5B RNA polymerase in complex with PF868554
分子名称: (6R)-6-cyclopentyl-6-[2-(2,6-diethylpyridin-4-yl)ethyl]-3-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-hydroxy-5,6-dihydro-2H-pyran-2-one, BETA-MERCAPTOETHANOL, N-[(benzyloxy)carbonyl]-L-alpha-glutamyl-N-[(1S)-4-oxo-4-phenyl-1-propylbut-2-en-1-yl]-L-phenylalaninamide, ...
著者Parge, H.E.
登録日2009-01-08
公開日2009-03-10
最終更新日2021-10-20
実験手法X-RAY DIFFRACTION (1.86 Å)
主引用文献Discovery of (R)-6-cyclopentyl-6-(2-(2,6-diethylpyridin-4-yl)ethyl)-3-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl)-4-hydroxy-5,6-dihydropyran-2-one (PF-00868554) as a potent and orally available hepatitis C virus polymerase inhibitor.
J.Med.Chem., 52, 2009
5JQN
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BU of 5jqn by Molmil
NitN Amidase from Neterenkonia sp. AN1 after thrombin His-tag removal.
分子名称: Aliphatic amidase
著者Sewell, B.T, Kimani, S.W, Weber, B.W.
登録日2016-05-05
公開日2016-05-18
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.19 Å)
主引用文献QM/MM Modelling of Substrate Binding in the Amidase Active Site
To Be Published
4IZW
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BU of 4izw by Molmil
The E41L mutant of the amidase from Nesterenkonia sp. AN1 showing covalent addition of the acetamide moiety of fluoroacetamide at the active site cysteine
分子名称: 2-fluoroacetamide, ACETAMIDE, Amidase
著者Kimani, S.W, Sewell, B.T.
登録日2013-01-30
公開日2014-02-12
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Covalent modifications of the active site cysteine occur as a result of mutating the glutamate of the catalytic triad in the amidase from Nesterenkonia sp.
To be Published
4IZU
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BU of 4izu by Molmil
The E41Q mutant of the amidase from Nesterenkonia sp. AN1 showing the result of Michael addition of acrylamide at the active site cysteine
分子名称: Amidase, PROPIONAMIDE, prop-2-enamide
著者Kimani, S.W, Sewell, B.T.
登録日2013-01-30
公開日2014-02-12
最終更新日2014-02-19
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Covalent modifications of the active site cysteine occur as a result of mutating the glutamate of the catalytic triad in the amidase from Nesterenkonia sp.
To be Published
4FRS
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BU of 4frs by Molmil
Structure of BACE in complex with (S)-4-(3-chloro-5-(5-(prop-1-yn-1-yl)pyridin-3-yl)thiophen-2-yl)-1,4-dimethyl-6-oxotetrahydropyrimidin-2(1H)-iminium
分子名称: (2Z,6S)-6-{3-chloro-5-[5-(prop-1-yn-1-yl)pyridin-3-yl]thiophen-2-yl}-2-imino-3,6-dimethyltetrahydropyrimidin-4(1H)-one, Beta-secretase 1
著者Orth, P.
登録日2012-06-26
公開日2012-08-08
最終更新日2013-06-19
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Discovery of an Orally Available, Brain Penetrant BACE1 Inhibitor That Affords Robust CNS A(beta) Reduction
ACS Med Chem Lett, 3, 2012

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件を2024-10-16に公開中

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