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5AQ6
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BU of 5aq6 by Molmil
Structure of E. coli ZinT at 1.79 Angstrom
Descriptor: ACETIC ACID, METAL-BINDING PROTEIN ZINT, ZINC ION
Authors:Santo, P.E, Colaco, H.G, Matias, P, Vicente, J.B, Bandeiras, T.M.
Deposit date:2015-09-21
Release date:2016-01-27
Last modified:2019-10-23
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Roles of Escherichia Coli Zint in Cobalt, Mercury and Cadmium Resistance and Structural Insights Into the Metal Binding Mechanism
Metallomics, 8, 2016
8C4L
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BU of 8c4l by Molmil
Ferric-siderophore reduction in Shewanella biscestrii: Structural and functional characterization of SbiSIP reveals unforeseen specificity
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Vibriobactin utilization protein ViuB
Authors:Trindade, I.B, Matias, P, Moe, E, Louro, R.O.
Deposit date:2023-01-04
Release date:2024-01-17
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Ferric-siderophore reduction in Shewanella bicestrii: Structural and functional characterization of SbSIP reveals an overlooked specificity of siderophore interacting proteins
To be published
1E5D
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BU of 1e5d by Molmil
RUBREDOXIN OXYGEN:OXIDOREDUCTASE (ROO) FROM ANAEROBE DESULFOVIBRIO GIGAS
Descriptor: FLAVIN MONONUCLEOTIDE, MU-OXO-DIIRON, OXYGEN MOLECULE, ...
Authors:Frazao, C, Silva, G, Gomes, C.M, Matias, P, Coelho, R, Sieker, L, Macedo, S, Liu, M.Y, Oliveira, S, Teixeira, M, Xavier, A.V, Rodrigues-Pousada, C, Carrondo, M.A, Le Gall, J.
Deposit date:2000-07-24
Release date:2000-11-17
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of a Dioxygen Reduction Enzyme from Desulfovibrio Gigas
Nat.Struct.Biol., 7, 2000
5J64
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BU of 5j64 by Molmil
Crystal Structure of Hsp90-alpha N-domain in complex with 5-(2,4-Dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one
Descriptor: 5-(2,4-dihydroxyphenyl)-4-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-04
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J20
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BU of 5j20 by Molmil
HSP90 in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-N-furan-2-ylmethyl-2,4-dihydroxy-N-methyl-benzamide
Descriptor: 5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-[(furan-2-yl)methyl]-2,4-dihydroxy-N-methylbenzamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-03-29
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J86
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BU of 5j86 by Molmil
Crystal Structure of Hsp90-alpha N-domain in complex with 2,4-Dihydroxy-N-methyl-5-(5-oxo-4-o-tolyl-4,5-dihydro-1H-[1,2,4]triazol-3-yl)-N-thiophen-2-ylmethyl-benzamide
Descriptor: 2,4-dihydroxy-N-methyl-5-[4-(2-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-[(thiophen-2-yl)methyl]benzamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-07
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J2V
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BU of 5j2v by Molmil
Crystal Structure of Hsp90-alpha Apo N-domain
Descriptor: Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-03-30
Release date:2017-10-11
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J6L
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BU of 5j6l by Molmil
Crystal Structure of Hsp90-alpha N-domain in complex with N-Butyl-5-[4-(2-fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-benzamide
Descriptor: Heat shock protein HSP 90-alpha, N-butyl-5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamide
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-05
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J2X
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BU of 5j2x by Molmil
Crystal Structure of Hsp90-alpha N-domain in complex with 5-(5-Bromo-2,4-dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one
Descriptor: 5-(5-Bromo-2,4-dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-03-30
Release date:2017-12-06
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (1.22 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J6M
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BU of 5j6m by Molmil
Crystal Structure of Hsp90-alpha N-domain L107 mutant in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-N-furan-2-ylmethyl-2,4-dihydroxy-N-methyl-benzamide
Descriptor: 5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-[(furan-2-yl)methyl]-2,4-dihydroxy-N-methylbenzamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-05
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.64 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J8M
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BU of 5j8m by Molmil
Crystal Structure of Hsp90-alpha N-domain L107A mutant in complex with 5-(5-Bromo-2,4-dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one
Descriptor: 5-(5-Bromo-2,4-dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-08
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J8U
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BU of 5j8u by Molmil
Crystal Structure of Hsp90-alpha N-domain L107A mutant in complex with 5-(2,4-Dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one
Descriptor: 5-(5-Bromo-2,4-dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-08
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J27
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BU of 5j27 by Molmil
HSP90 in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propyl-benzenesulfonamide
Descriptor: 5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propylbenzene-1-sulfonamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-03-29
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J80
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BU of 5j80 by Molmil
Crystal Structure of Apo Hsp90-alpha N-domain L107A mutant
Descriptor: Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-07
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.17 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J6N
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BU of 5j6n by Molmil
Crystal Structure of Hsp90-alpha N-domain L107A mutant in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propyl-benzenesulfonamide
Descriptor: 5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propylbenzene-1-sulfonamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-05
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J82
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BU of 5j82 by Molmil
Crystal Structure of Hsp90-alpha N-domain in complex 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-methyl-benzenesulfonamide
Descriptor: 5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl-N-(propan-2-yl)benzene-1-sulfonamide, Heat shock protein HSP 90-alpha
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-07
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
5J9X
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BU of 5j9x by Molmil
HSP90 in complex with N-Butyl-5-[4-(2-fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-benzamide
Descriptor: DIMETHYL SULFOXIDE, Heat shock protein HSP 90-alpha, N-butyl-5-[4-(2-fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methylbenzamide
Authors:Amaral, M, Matias, P.
Deposit date:2016-04-11
Release date:2017-12-06
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Protein conformational flexibility modulates kinetics and thermodynamics of drug binding.
Nat Commun, 8, 2017
7OYI
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BU of 7oyi by Molmil
Escherichia coli YtfE_E159L(MN)
Descriptor: CHLORIDE ION, GLYCEROL, Iron-sulfur cluster repair protein YtfE, ...
Authors:Silva, L.S.O, Matias, P, Romao, C.V, Saraiva, L.M.
Deposit date:2021-06-24
Release date:2022-07-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Repair of Iron Center Proteins-A Different Class of Hemerythrin-like Proteins.
Molecules, 27, 2022
1DFX
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BU of 1dfx by Molmil
DESULFOFERRODOXIN FROM DESULFOVIBRIO DESULFURICANS, ATCC 27774
Descriptor: CALCIUM ION, DESULFOFERRODOXIN, FE (III) ION
Authors:Coelho, A.V, Matias, P.M, Carrondo, M.A.
Deposit date:1997-09-03
Release date:1998-10-14
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Desulfoferrodoxin Structure Determined by MAD Phasing and Refinement to 1.9 Angstroms Resolution Reveals a Unique Combination of a Tetrahedral Fes4 Centre with a Square Pyramidal Fesn4 Centre
J.Biol.Inorg.Chem., 2, 1997
6GEH
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BU of 6geh by Molmil
Structure and reactivity of a siderophore-interacting protein from the marine bacterium Shewanella reveals unanticipated functional versatility.
Descriptor: DIMETHYL SULFOXIDE, FAD-binding 9, siderophore-interacting domain protein, ...
Authors:Trindade, I.B, Silva, J.P.M, Matias, P, Moe, E.
Deposit date:2018-04-26
Release date:2018-11-21
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.15 Å)
Cite:Structure and reactivity of a siderophore-interacting protein from the marine bacteriumShewanellareveals unanticipated functional versatility.
J. Biol. Chem., 294, 2019
6H7X
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BU of 6h7x by Molmil
First X-ray structure of full-length human RuvB-Like 2.
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ...
Authors:Silva, S, Brito, J.A, Matias, P, Bandeiras, T.
Deposit date:2018-07-31
Release date:2018-08-08
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.892 Å)
Cite:X-ray structure of full-length human RuvB-Like 2 - mechanistic insights into coupling between ATP binding and mechanical action.
Sci Rep, 8, 2018
6HR0
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BU of 6hr0 by Molmil
Optimizing electroactive organisms: the effect of orthologous proteins
Descriptor: Cytochrome C, HEME C, PHOSPHITE ION
Authors:Trindade, I.B, Moe, E, Matias, P.
Deposit date:2018-09-26
Release date:2019-10-16
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.04 Å)
Cite:Optimizing electroactive organisms: the effect of orthologous proteins
Frontiers in Energy Research, 2019
4C4U
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BU of 4c4u by Molmil
Superoxide reductase (Neelaredoxin) from Archaeoglobus fulgidus E12Q mutant in the reduced form
Descriptor: FE (II) ION, SUPEROXIDE REDUCTASE
Authors:Bandeiras, T.M, Rodrigues, J.V, Sousa, C.M, Barradas, A.R, Pinho, F.G, Pinto, A.F, Teixeira, M, Matias, P.M, Romao, C.V.
Deposit date:2013-09-09
Release date:2014-08-06
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.583 Å)
Cite:Understanding the Role of Key Residues in the Superoxide Reductase Molecular Mechanism, Exploring Archaeoglobus Fulgidus Sor Structure
To be Published
8RE3
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BU of 8re3 by Molmil
Crystal Structure determination of Dye-decolorizing Peroxidase (DyP) mutant M190G from Deinoccoccus radiodurans
Descriptor: CALCIUM ION, CHLORIDE ION, HYDROXIDE ION, ...
Authors:Salgueiro, B.A, Frade, K, Frazao, C, Matias, P, Moe, E.
Deposit date:2023-12-10
Release date:2024-01-31
Method:X-RAY DIFFRACTION (1.51 Å)
Cite:Biochemical, Biophysical, and Structural Analysis of an Unusual DyP from the Extremophile Deinococcus radiodurans.
Molecules, 29, 2024

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