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6G81
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BU of 6g81 by Molmil
Solution structure of the Ni metallochaperone HypA from Helicobacter pylori
Descriptor: Hydrogenase maturation factor HypA, ZINC ION
Authors:Spronk, C.A.E.M, Zerko, S, Gorka, M, Kozminski, W, Bardiaux, B, Zambelli, B, Musiani, F, Piccioli, M, Hu, H, Maroney, M, Ciurli, S.
Deposit date:2018-04-07
Release date:2018-10-10
Last modified:2024-06-19
Method:SOLUTION NMR
Cite:Structure and dynamics of Helicobacter pylori nickel-chaperone HypA: an integrated approach using NMR spectroscopy, functional assays and computational tools.
J. Biol. Inorg. Chem., 23, 2018
7B5A
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BU of 7b5a by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)2NO3 determined at 1.97 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
7B58
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BU of 7b58 by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)Cl determined at 1.72 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
7B59
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BU of 7b59 by Molmil
X-ray crystal structure of Sporosarcina pasteurii urease inhibited by Ag(PEt3)Br determined at 1.63 Angstroms
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2020-12-03
Release date:2021-10-13
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.63 Å)
Cite:Kinetic and structural analysis of the inactivation of urease by mixed-ligand phosphine halide Ag(I) complexes.
J.Inorg.Biochem., 218, 2021
5N76
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BU of 5n76 by Molmil
Crystal structure of the apo-form of the CO dehydrogenase accessory protein CooT from Rhodospirillum rubrum
Descriptor: CooT
Authors:Timm, J, Brochier-Armanet, C, Perard, J, Zambelli, B, Ollagnier-de-Choudens, S, Ciurli, S, Cavazza, C.
Deposit date:2017-02-19
Release date:2017-05-10
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The CO dehydrogenase accessory protein CooT is a novel nickel-binding protein.
Metallomics, 9, 2017
6G48
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BU of 6g48 by Molmil
Sporosarcina pasteurii urease inhibited by silver
Descriptor: 1,2-ETHANEDIOL, HYDROXIDE ION, NICKEL (II) ION, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2018-03-27
Release date:2019-01-16
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.91 Å)
Cite:The structure of urease inactivated by Ag(i): a new paradigm for enzyme inhibition by heavy metals.
Dalton Trans, 47, 2018
7P6F
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BU of 7p6f by Molmil
1.93 A resolution X-ray crystal structure of the transcriptional regulator SrnR from Streptomyces griseus
Descriptor: ACETATE ION, SODIUM ION, Transcriptional regulator SrnR
Authors:Mazzei, L, Ciurli, S.
Deposit date:2021-07-16
Release date:2022-05-25
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Structure, dynamics, and function of SrnR, a transcription factor for nickel-dependent gene expression.
Metallomics, 13, 2021
1JXF
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BU of 1jxf by Molmil
SOLUTION STRUCTURE OF REDUCED CU(I) PLASTOCYANIN FROM SYNECHOCYSTIS PCC6803
Descriptor: COPPER (II) ION, PLASTOCYANIN
Authors:Bertini, I, Bryant, D.A, Ciurli, S, Dikiy, A, Fernandez, C.O, Luchinat, C, Safarov, N, Vila, A.J, Zhao, J.
Deposit date:2001-09-07
Release date:2001-09-26
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Backbone dynamics of plastocyanin in both oxidation states. Solution structure of the reduced form and comparison with the oxidized state.
J.Biol.Chem., 276, 2001
1JXD
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BU of 1jxd by Molmil
SOLUTION STRUCTURE OF REDUCED CU(I) PLASTOCYANIN FROM SYNECHOCYSTIS PCC6803
Descriptor: COPPER (II) ION, PLASTOCYANIN
Authors:Bertini, I, Bryant, D.A, Ciurli, S, Dikiy, A, Fernandez, C.O, Luchinat, C, Safarov, N, Vila, A.J, Zhao, J.
Deposit date:2001-09-07
Release date:2001-09-26
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Backbone dynamics of plastocyanin in both oxidation states. Solution structure of the reduced form and comparison with the oxidized state.
J.Biol.Chem., 276, 2001
6HK5
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BU of 6hk5 by Molmil
X-ray structure of a truncated mutant of the metallochaperone CooJ with a high-affinity nickel-binding site
Descriptor: 3,3',3''-phosphoryltripropanoic acid, CALCIUM ION, CHLORIDE ION, ...
Authors:Alfano, M, Perard, J, Basset, C, Carpentier, P, Zambelli, B, Timm, J, Crouzy, S, Ciurli, S, Cavazza, C.
Deposit date:2018-09-05
Release date:2019-03-27
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (2.042 Å)
Cite:The carbon monoxide dehydrogenase accessory protein CooJ is a histidine-rich multidomain dimer containing an unexpected Ni(II)-binding site.
J.Biol.Chem., 294, 2019
5OL4
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BU of 5ol4 by Molmil
1.28 A resolution of Sporosarcina pasteurii urease inhibited in the presence of NBPT
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, Phosphoramidothioic O,O-acid, ...
Authors:Mazzei, L, Cianci, M, Musiani, F, Ciurli, S.
Deposit date:2017-07-26
Release date:2018-03-07
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.28 Å)
Cite:Urease Inhibition in the Presence of N-(n-Butyl)thiophosphoric Triamide, a Suicide Substrate: Structure and Kinetics.
Biochemistry, 56, 2017
2J8W
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BU of 2j8w by Molmil
The crystal structure of cytochrome c' from Rubrivivax gelatinosus at 1.3 A Resolution and pH 8.0
Descriptor: CYTOCHROME C', HEME C
Authors:Benini, S, Ciurli, S, Rypniewski, W.R, Wilson, K.S.
Deposit date:2006-10-30
Release date:2007-11-06
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.29 Å)
Cite:High resolution crystal structure of Rubrivivax gelatinosus cytochrome c'.
J. Inorg. Biochem., 102, 2008
7P7N
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BU of 7p7n by Molmil
X-RAY CRYSTAL STRUCTURE OF SPOROSARCINA PASTEURII UREASE INHIBITED BY THE GOLD(I)-PHOSPHINE COMPOUND Au(PEt3)I DETERMINED AT 1.80 ANGSTROMS
Descriptor: 1,2-ETHANEDIOL, GOLD ION, NICKEL (II) ION, ...
Authors:Mazzei, L, Ciurli, S.
Deposit date:2021-07-20
Release date:2022-06-01
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Medicinal Au(I) compounds targeting urease as prospective antimicrobial agents: unveiling the structural basis for enzyme inhibition.
Dalton Trans, 50, 2021
7P7O
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BU of 7p7o by Molmil
X-RAY CRYSTAL STRUCTURE OF SPOROSARCINA PASTEURII UREASE INHIBITED BY THE GOLD(I)-DIPHOSPHINE COMPOUND Au(PEt3)2Cl DETERMINED AT 1.87 ANGSTROMS
Descriptor: 1,2-ETHANEDIOL, NICKEL (II) ION, OXYGEN ATOM, ...
Authors:Mazzei, L, Ciurli, S, Cianci, M, Messori, L, Massai, L.
Deposit date:2021-07-20
Release date:2022-06-01
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Medicinal Au(I) compounds targeting urease as prospective antimicrobial agents: unveiling the structural basis for enzyme inhibition.
Dalton Trans, 50, 2021
6I9Y
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BU of 6i9y by Molmil
The 2.14 A X-ray crystal structure of Sporosarcina pasteurii urease in complex with Au(I) ions
Descriptor: 1,2-ETHANEDIOL, GOLD ION, HYDROXIDE ION, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2018-11-26
Release date:2019-05-01
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Inhibition Mechanism of Urease by Au(III) Compounds Unveiled by X-ray Diffraction Analysis.
Acs Med.Chem.Lett., 10, 2019
5FSD
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BU of 5fsd by Molmil
1.75 A resolution 2,5-dihydroxybenzensulfonate inhibited Sporosarcina pasteurii urease
Descriptor: 1,2-ETHANEDIOL, 2,5-dihydroxybenzenesulfonic acid, HYDROXIDE ION, ...
Authors:Mazzei, L, Cianci, M, Musiani, F, Ciurli, S.
Deposit date:2016-01-04
Release date:2016-03-23
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Inactivation of Urease by 1,4-Benzoquinone: Chemistry at the Protein Surface.
Dalton Trans, 45, 2016
6H8J
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BU of 6h8j by Molmil
1.45 A resolution of Sporosarcina pasteurii urease inhibited in the presence of NBPTO
Descriptor: 1,2-ETHANEDIOL, DIAMIDOPHOSPHATE, NICKEL (II) ION, ...
Authors:Mazzei, L, Cianci, M, Ciurli, S.
Deposit date:2018-08-02
Release date:2019-06-12
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Insights into Urease Inhibition by N-( n-Butyl) Phosphoric Triamide through an Integrated Structural and Kinetic Approach.
J.Agric.Food Chem., 67, 2019
5G4H
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BU of 5g4h by Molmil
1.50 A resolution catechol (1,2-dihydroxybenzene) inhibited Sporosarcina pasteurii urease
Descriptor: 1,2-ETHANEDIOL, CATECHOL, HYDROXIDE ION, ...
Authors:Mazzei, L, Cianci, M, Musiani, F, Ciurli, S.
Deposit date:2016-05-13
Release date:2016-12-07
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Inactivation of Urease by Catechol: Kinetics and Structure.
J.Inorg.Biochem., 166, 2016
5FSE
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BU of 5fse by Molmil
2.07 A resolution 1,4-Benzoquinone inhibited Sporosarcina pasteurii urease
Descriptor: 1,2-ETHANEDIOL, HYDROXIDE ION, NICKEL (II) ION, ...
Authors:Mazzei, L, Cianci, M, Musiani, F, Ciurli, S.
Deposit date:2016-01-04
Release date:2016-03-23
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.07 Å)
Cite:Inactivation of Urease by 1,4-Benzoquinone: Chemistry at the Protein Surface.
Dalton Trans, 45, 2016
2MM8
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BU of 2mm8 by Molmil
Structural and biochemical characterization of Jaburetox
Descriptor: Urease
Authors:Dobrovolska, O, Lopez, F, Ciurli, S, Zambelli, B, Carlini, C.
Deposit date:2014-03-12
Release date:2015-01-28
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:1H, 13C, 15N resonance assignments of reduced Jaburetox
To be Published
4L3K
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BU of 4l3k by Molmil
Crystal structure of Sporosarcina pasteurii UreE bound to Ni2+ and Zn2+
Descriptor: NICKEL (II) ION, Urease accessory protein UreE, ZINC ION
Authors:Zambelli, B, Banaszak, K, Merloni, A, Kiliszek, A, Rypniewski, W.R, Ciurli, S.
Deposit date:2013-06-06
Release date:2013-10-09
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Selectivity of Ni(II) and Zn(II) binding to Sporosarcina pasteurii UreE, a metallochaperone in the urease assembly: a calorimetric and crystallographic study.
J.Biol.Inorg.Chem., 18, 2013
3TJA
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BU of 3tja by Molmil
Crystal structure of Helicobacter pylori UreE in the apo form
Descriptor: CHLORIDE ION, SULFATE ION, Urease accessory protein ureE
Authors:Banaszak, K, Bellucci, M, Zambelli, B, Rypniewski, W.R, Ciurli, S.
Deposit date:2011-08-24
Release date:2011-11-02
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystallographic and X-ray absorption spectroscopic characterization of Helicobacter pylori UreE bound to Ni2+ and Zn2+ reveals a role for the disordered C-terminal arm in metal trafficking.
Biochem.J., 441, 2012
3TJ9
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BU of 3tj9 by Molmil
Crystal structure of Helicobacter pylori UreE bound to Zn2+
Descriptor: FORMIC ACID, Urease accessory protein ureE, ZINC ION
Authors:Banaszak, K, Bellucci, M, Zambelli, B, Rypniewski, W.R, Ciurli, S.
Deposit date:2011-08-24
Release date:2011-11-02
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (2.521 Å)
Cite:Crystallographic and X-ray absorption spectroscopic characterization of Helicobacter pylori UreE bound to Ni2+ and Zn2+ reveals a role for the disordered C-terminal arm in metal trafficking.
Biochem.J., 441, 2012
3TJ8
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BU of 3tj8 by Molmil
Crystal structure of Helicobacter pylori UreE bound to Ni2+
Descriptor: FORMIC ACID, NICKEL (II) ION, Urease accessory protein ureE
Authors:Banaszak, K, Bellucci, M, Zambelli, B, Rypniewski, W.R, Ciurli, S.
Deposit date:2011-08-24
Release date:2011-11-02
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.591 Å)
Cite:Crystallographic and X-ray absorption spectroscopic characterization of Helicobacter pylori UreE bound to Ni2+ and Zn2+ reveals a role for the disordered C-terminal arm in metal trafficking.
Biochem.J., 441, 2012
6ZNZ
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BU of 6znz by Molmil
1.89 A resolution 4-methylcatechol (4-methylbenzene-1,2-diol) inhibited Sporosarcina pasteurii urease
Descriptor: 1,2-ETHANEDIOL, HYDROXIDE ION, NICKEL (II) ION, ...
Authors:Mazzei, L, Cianci, M, Musiani, F, Ciurli, S.
Deposit date:2020-07-07
Release date:2020-12-23
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Inhibition of Urease, a Ni-Enzyme: The Reactivity of a Key Thiol With Mono- and Di-Substituted Catechols Elucidated by Kinetic, Structural, and Theoretical Studies.
Angew.Chem.Int.Ed.Engl., 60, 2021

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