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3SD9
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BU of 3sd9 by Molmil
Crystal structure of serratia fonticola SFH-I: Source of the nucleophile in the catalytic mechanism of mono-zinc metallo-beta-lactamases
分子名称: Beta-lactamase, ZINC ION
著者Fonseca, F, Saavedra, M.J, Correia, A, Spencer, J.
登録日2011-06-08
公開日2011-07-13
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Crystal Structure of Serratia fonticola Sfh-I: Activation of the Nucleophile in Mono-Zinc Metallo-beta-Lactamases
To be Published, 2011
3Q6V
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BU of 3q6v by Molmil
Crystal Structure of Serratia fonticola Sfh-I: glycerol complex
分子名称: Beta-lactamase, GLYCEROL, ZINC ION
著者Fonseca, F, Saavedra, M.J, Correia, A, Spencer, J.
登録日2011-01-03
公開日2011-07-13
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Crystal structure of Serratia fonticola Sfh-I: activation of the nucleophile in mono-zinc metallo-beta-lactamases.
J.Mol.Biol., 411, 2011
4EV4
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BU of 4ev4 by Molmil
Crystal structure of serratia fonticola carbapenemase SFC-1 E166A mutant with the acylenzyme intermediate of meropenem
分子名称: (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, 1,2-ETHANEDIOL, Carbapenem-hydrolizing beta-lactamase SFC-1
著者Fonseca, F, Spencer, J.
登録日2012-04-25
公開日2012-05-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献The basis for carbapenem hydrolysis by class A beta-lactamases: a combined investigation using crystallography and simulations.
J.Am.Chem.Soc., 134, 2012
4EQI
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BU of 4eqi by Molmil
Crystal structure of serratia fonticola carbapenemase SFC-1
分子名称: 1,2-ETHANEDIOL, Carbapenem-hydrolizing beta-lactamase SFC-1, SODIUM ION
著者Fonseca, F, Spencer, J.
登録日2012-04-18
公開日2012-05-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.38 Å)
主引用文献The basis for carbapenem hydrolysis by class A beta-lactamases: a combined investigation using crystallography and simulations.
J.Am.Chem.Soc., 134, 2012
4EUZ
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BU of 4euz by Molmil
Crystal structure of serratia fonticola carbapenemase SFC-1 S70A-Meropenem complex
分子名称: (4R,5S,6S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 1,2-ETHANEDIOL, Carbapenem-hydrolizing beta-lactamase SFC-1, ...
著者Fonseca, F, Spencer, J.
登録日2012-04-25
公開日2012-05-23
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.08 Å)
主引用文献The basis for carbapenem hydrolysis by class A beta-lactamases: a combined investigation using crystallography and simulations.
J.Am.Chem.Soc., 134, 2012
4MUV
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BU of 4muv by Molmil
M. loti cyclic-nucleotide binding domain mutant displaying inverted ligand selectivity, cyclic-GMP bound
分子名称: CYCLIC GUANOSINE MONOPHOSPHATE, Cyclic nucleotide-gated potassium channel mll3241, SODIUM ION
著者Fonseca, F, Pessoa, J, Morais-Cabral, J.H.
登録日2013-09-23
公開日2014-06-25
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.25 Å)
主引用文献Determinants of ligand selectivity in a cyclic nucleotide-regulated potassium channel.
J.Gen.Physiol., 144, 2014
6S5B
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BU of 6s5b by Molmil
Non-square conformation of KtrA R16K mutant ring with bound ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-01
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.052 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S7R
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BU of 6s7r by Molmil
Non-square conformations of KtrA R16A mutant rings with bound ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-05
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.73 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5D
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BU of 6s5d by Molmil
Square conformation of KtrA R16A mutant ring with bound ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Ktr system potassium uptake protein A, MAGNESIUM ION
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-01
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.393 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5G
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BU of 6s5g by Molmil
Non-square conformation of KtrA A80P mutant ring with bound ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-01
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (4.33 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5E
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BU of 6s5e by Molmil
Non-square conformation of KtrA A80P mutant ring with bound ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-01
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.893 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S2J
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BU of 6s2j by Molmil
Square conformation of KtrA R16K mutant ring with bound ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Ktr system potassium uptake protein A, MAGNESIUM ION
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-06-21
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.67 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5N
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BU of 6s5n by Molmil
Non-square conformations of KtrA E125Q mutant rings with bound ATP
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-02
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (4.09 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5C
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BU of 6s5c by Molmil
Square conformation of KtrA WT ring with bound ATP and calcium
分子名称: ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-01
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6S5O
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BU of 6s5o by Molmil
Non-square conformations of KtrA E125Q mutant rings with bound ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Ktr system potassium uptake protein A
著者Teixeira-Duarte, C.M, Fonseca, F, Morais-Cabral, J.H.
登録日2019-07-02
公開日2020-01-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.983 Å)
主引用文献Activation of a nucleotide-dependent RCK domain requires binding of a cation cofactor to a conserved site.
Elife, 8, 2019
6DMH
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BU of 6dmh by Molmil
A multiconformer ligand model of acylenzyme intermediate of meropenem bound to an SFC-1 E166A mutant
分子名称: (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, 1,2-ETHANEDIOL, Beta-lactamase
著者Hudson, B.M, van Zundert, G, Keedy, D.A, Fonseca, R, Heliou, A, Suresh, P, Borrelli, K, Day, T, Fraser, J.S, van den Bedem, H.
登録日2018-06-05
公開日2018-12-19
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献qFit-ligand Reveals Widespread Conformational Heterogeneity of Drug-Like Molecules in X-Ray Electron Density Maps.
J. Med. Chem., 61, 2018
5FG8
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BU of 5fg8 by Molmil
Drosophila CaMKII-wt in complex with a fragment of the Eag potassium channel and Mg2+/ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Calcium/calmodulin-dependent protein kinase type II alpha chain, GLYCEROL, ...
著者Castro-Rodrigues, A.F, Morais-Cabral, J.H.
登録日2015-12-20
公開日2016-12-28
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.955 Å)
主引用文献The Interaction between the Drosophila EAG Potassium Channel and the Protein Kinase CaMKII Involves an Extensive Interface at the Active Site of the Kinase.
J.Mol.Biol., 430, 2018
5H9B
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BU of 5h9b by Molmil
Drosophila CaMKII-wt in complex with a fragment of the Eag potassium channel and Mg2+/AMPPN
分子名称: AMP PHOSPHORAMIDATE, Calcium/calmodulin-dependent protein kinase II, isoform C, ...
著者Castro-Rodrigues, A.F, Morais-Cabral, J.H.
登録日2015-12-27
公開日2017-01-11
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献The Interaction between the Drosophila EAG Potassium Channel and the Protein Kinase CaMKII Involves an Extensive Interface at the Active Site of the Kinase.
J.Mol.Biol., 430, 2018
5HU3
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BU of 5hu3 by Molmil
Drosophila CaMKII-D136N in complex with a phosphorylated fragment of the Eag potassium channel and Mg2+/ADP
分子名称: ADENOSINE-5'-DIPHOSPHATE, Calcium/calmodulin-dependent protein kinase type II alpha chain, MAGNESIUM ION, ...
著者Castro-Rodrigues, A.F, Morais-Cabral, J.H.
登録日2016-01-27
公開日2017-02-01
最終更新日2019-11-13
実験手法X-RAY DIFFRACTION (1.885 Å)
主引用文献The Interaction between the Drosophila EAG Potassium Channel and the Protein Kinase CaMKII Involves an Extensive Interface at the Active Site of the Kinase.
J.Mol.Biol., 430, 2018

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