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1ALG
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BU of 1alg by Molmil
SOLUTION STRUCTURE OF AN HGR INHIBITOR, NMR, 10 STRUCTURES
Descriptor: P11
Authors:Schott, M.K, Nordhoff, A, Becker, K, Kalbitzer, H.R, Schirmer, R.H.
Deposit date:1997-06-03
Release date:1997-10-15
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Denaturation and reactivation of dimeric human glutathione reductase--an assay for folding inhibitors.
Eur.J.Biochem., 245, 1997
2AAQ
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BU of 2aaq by Molmil
Crystal Structure Analysis of the human Glutahione Reductase, complexed with GoPI
Descriptor: 2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-TETRAHYDRO-2H-ISOPHOSPHINDOL-1-YL)PYRIDINE, CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Urig, S, Fritz-Wolf, K, Reau, R, Herold-Mende, C, Toth, K, Davioud-Charvet, E, Becker, K.
Deposit date:2005-07-14
Release date:2006-04-04
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Undressing of Phosphine Gold(I) Complexes as Irreversible Inhibitors of Human Disulfide Reductases.
Angew.Chem.Int.Ed.Engl., 45, 2006
1K4Q
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BU of 1k4q by Molmil
Human Glutathione Reductase Inactivated by Peroxynitrite
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Glutathione Reductase
Authors:Savvides, S.N, Scheiwein, M, Boehme, C.C, Arteel, G.E, Karplus, P.A, Becker, K, Schirmer, R.H.
Deposit date:2001-10-08
Release date:2002-01-30
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of the antioxidant enzyme glutathione reductase inactivated by peroxynitrite.
J.Biol.Chem., 277, 2002
2AAW
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BU of 2aaw by Molmil
Studies on ligand binding and enzyme inhibition of Plasmodium falciparum glutathione S-transferase
Descriptor: 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, L-TREITOL, S-HEXYLGLUTATHIONE, ...
Authors:Hiller, N, Fritz-Wolf, K, Deponte, M, Wende, W, Zimmermann, H, Becker, K.
Deposit date:2005-07-14
Release date:2006-01-10
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Plasmodium falciparum glutathione S-transferase--structural and mechanistic studies on ligand binding and enzyme inhibition.
Protein Sci., 15, 2006
1XWB
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BU of 1xwb by Molmil
Drospohila thioredoxin, oxidized, P42212
Descriptor: CADMIUM ION, thioredoxin
Authors:Wahl, M.C, Irmler, A, Hecker, B, Schirmer, R.H, Becker, K.
Deposit date:2004-10-29
Release date:2004-11-16
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Comparative structural analysis of oxidized and reduced thioredoxin from Drosophila melanogaster
J.Mol.Biol., 345, 2005
1XWA
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BU of 1xwa by Molmil
Drospohila thioredoxin, oxidized, P41212
Descriptor: CADMIUM ION, CHLORIDE ION, thioredoxin
Authors:Wahl, M.C, Irmler, A, Hecker, B, Schirmer, R.H, Becker, K.
Deposit date:2004-10-29
Release date:2004-11-16
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Comparative structural analysis of oxidized and reduced thioredoxin from Drosophila melanogaster
J.Mol.Biol., 345, 2005
1XW9
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BU of 1xw9 by Molmil
Drosophila thioredoxin, oxidized, P21
Descriptor: thioredoxin
Authors:Wahl, M.C, Irmler, A, Hecker, B, Schirmer, R.H, Becker, K.
Deposit date:2004-10-29
Release date:2004-11-16
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Comparative structural analysis of oxidized and reduced thioredoxin from Drosophila melanogaster
J.Mol.Biol., 345, 2005
1XWC
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BU of 1xwc by Molmil
Drosophila thioredoxin, reduced, P6522
Descriptor: thioredoxin
Authors:Wahl, M.C, Irmler, A, Hecker, B, Schirmer, R.H, Becker, K.
Deposit date:2004-10-29
Release date:2004-11-16
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Comparative structural analysis of oxidized and reduced thioredoxin from Drosophila melanogaster
J.Mol.Biol., 345, 2005
1XIY
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BU of 1xiy by Molmil
Crystal Structure of Plasmodium falciparum antioxidant protein (1-Cys peroxiredoxin)
Descriptor: peroxiredoxin
Authors:Sarma, G.N, Fischer, M, Nickel, C, Becker, K, Karplus, P.A.
Deposit date:2004-09-22
Release date:2005-02-15
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of a novel Plasmodium falciparum 1-Cys peroxiredoxin.
J.Mol.Biol., 346, 2005
1SNY
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BU of 1sny by Molmil
Carbonyl reductase Sniffer of D. melanogaster
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, sniffer CG10964-PA
Authors:Sgraja, T, Ulschmid, J, Becker, K, Schneuwly, S, Klebe, G, Reuter, K, Heine, A.
Deposit date:2004-03-12
Release date:2004-09-28
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structural Insights into the Neuroprotective-acting Carbonyl Reductase Sniffer of Drosophila melanogaster.
J.Mol.Biol., 342, 2004
3R3J
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BU of 3r3j by Molmil
Kinetic and structural characterization of Plasmodium falciparum glutamate dehydrogenase 2
Descriptor: Glutamate dehydrogenase
Authors:Zocher, K, Fritz-Wolf, K, Kehr, S, Rahlfs, S, Becker, K.
Deposit date:2011-03-16
Release date:2012-03-07
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Biochemical and structural characterization of Plasmodium falciparum glutamate dehydrogenase 2.
Mol.Biochem.Parasitol., 183, 2012
3QFA
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BU of 3qfa by Molmil
Crystal structure of the human thioredoxin reductase-thioredoxin complex
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, Thioredoxin, ...
Authors:Fritz-Wolf, K, Kehr, S, Stumpf, M, Rahlfs, S, Becker, K.
Deposit date:2011-01-21
Release date:2011-07-27
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure of the human thioredoxin reductase-thioredoxin complex
Nat Commun, 2, 2011
3QFB
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BU of 3qfb by Molmil
Crystal structure of the human thioredoxin reductase-thioredoxin complex
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, Thioredoxin, ...
Authors:Fritz-Wolf, K, Kehr, S, Stumpf, M, Rahlfs, S, Becker, K.
Deposit date:2011-01-21
Release date:2011-07-27
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structure of the human thioredoxin reductase-thioredoxin complex
Nat Commun, 2, 2011
4N10
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BU of 4n10 by Molmil
Crystal structure of plasmodium falciparum oxidized glutaredoxin 1 (PfGrx1) complexed with cisplatin
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, Cisplatin, ...
Authors:Yogavel, M, Sharma, A.
Deposit date:2013-10-03
Release date:2014-10-08
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Interaction of Cisplatin with plasmodium falciparum Glutaredoxin 1
To be Published
4N11
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BU of 4n11 by Molmil
Crystal structure of plasmodium falciparum reduced glutaredoxin 1 (PfGrx1) complexed with cisplatin
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, Cisplatin, ...
Authors:Yogavel, M, Sharma, A.
Deposit date:2013-10-03
Release date:2014-10-08
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Interaction of Cisplatin with plasmodium falciparum Glutaredoxin 1
To be Published
4N0Z
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BU of 4n0z by Molmil
Crystal structure of cisplatin bound to a plasmodium falciparum glutaredoxin 1 (PfGrx1)
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, Cisplatin, ...
Authors:Yogavel, M, Sharma, A.
Deposit date:2013-10-03
Release date:2014-10-08
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Interaction of Cisplatin with plasmodium falciparum Glutaredoxin 1
To be Published
5LW7
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BU of 5lw7 by Molmil
S. solfataricus ABCE1 post-splitting state
Descriptor: ABC transporter ATP-binding protein, IRON/SULFUR CLUSTER
Authors:Heuer, A, Gerovac, M, Beckmann, R, Tampe, R.
Deposit date:2016-09-15
Release date:2016-11-16
Last modified:2019-02-20
Method:ELECTRON MICROSCOPY (17 Å)
Cite:Structure of the ribosome post-recycling complex probed by chemical cross-linking and mass spectrometry.
Nat Commun, 7, 2016
5DPX
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BU of 5dpx by Molmil
1,2,4-Triazole-3-thione compounds as inhibitors of L1, di-zinc metallo-beta-lactamases.
Descriptor: 5-(2-methylphenyl)-3H-1,2,4-triazole-3-thione, Metallo-beta-lactamase L1 type 3, SULFATE ION, ...
Authors:Nauton, L, Garau, G, Khan, R, Dideberg, O.
Deposit date:2015-09-14
Release date:2017-01-11
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:1,2,4-Triazole-3-thione Compounds as Inhibitors of Dizinc Metallo-beta-lactamases.
ChemMedChem, 12, 2017
8B1O
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BU of 8b1o by Molmil
Crystal structure of SUDV VP40 C314S mutant
Descriptor: Matrix protein VP40
Authors:Werner, A.-D, Becker, S.
Deposit date:2022-09-11
Release date:2023-06-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:The C-terminus of Sudan ebolavirus VP40 contains a functionally important CX n C motif, a target for redox modifications.
Structure, 31, 2023
8B1P
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BU of 8b1p by Molmil
Crystal structure of SUDV VP40 CCS mutant
Descriptor: Matrix protein VP40
Authors:Werner, A.-D, Becker, S.
Deposit date:2022-09-11
Release date:2023-06-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The C-terminus of Sudan ebolavirus VP40 contains a functionally important CX n C motif, a target for redox modifications.
Structure, 31, 2023
8B3X
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BU of 8b3x by Molmil
High resolution crystal structure of dimeric SUDV VP40
Descriptor: Matrix protein VP40
Authors:Werner, A.-D, Norris, M, Saphire, E.O, Becker, S.
Deposit date:2022-09-17
Release date:2023-06-21
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.531 Å)
Cite:The C-terminus of Sudan ebolavirus VP40 contains a functionally important CX n C motif, a target for redox modifications.
Structure, 31, 2023
6YRP
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BU of 6yrp by Molmil
Crystal Structure of the VIM-2 Acquired Metallo-beta-Lactamase in Complex with JMV-4690 (Cpd 31)
Descriptor: 1,2-ETHANEDIOL, 2-[[[3-(5-methoxy-2-oxidanyl-phenyl)-5-sulfanylidene-1~{H}-1,2,4-triazol-4-yl]amino]methyl]benzoic acid, ACETATE ION, ...
Authors:Docquier, J.D, Pozzi, C, De Luca, F, Benvenuti, M, Mangani, S.
Deposit date:2020-04-20
Release date:2020-09-30
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:4-Amino-1,2,4-triazole-3-thione-derived Schiff bases as metallo-beta-lactamase inhibitors.
Eur.J.Med.Chem., 208, 2020
4MZC
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BU of 4mzc by Molmil
Atomic Resolution Structure of PfGrx1
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, Glutaredoxin
Authors:Yogavel, M, Sharma, A.
Deposit date:2013-09-30
Release date:2013-10-09
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (0.949 Å)
Cite:Atomic resolution crystal structure of glutaredoxin 1 from Plasmodium falciparum and comparison with other glutaredoxins.
Acta Crystallogr.,Sect.D, 70, 2014
4MZB
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BU of 4mzb by Molmil
Crystal structure of Grx1 from Plasmodium falciparum
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, Glutaredoxin
Authors:Yogavel, M, Sharma, A.
Deposit date:2013-09-30
Release date:2013-10-09
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.038 Å)
Cite:Atomic resolution crystal structure of glutaredoxin 1 from Plasmodium falciparum and comparison with other glutaredoxins.
Acta Crystallogr.,Sect.D, 70, 2014
7OVH
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BU of 7ovh by Molmil
Crystal structure of the VIM-2 acquired metallo-beta-Lactamase in Complex with compound 14 (JMV-6931)
Descriptor: ACETATE ION, Metallo-beta-lactamase VIM-2-like protein, UNKNOWN LIGAND, ...
Authors:Tassone, G, Benvenuti, M, Verdirosa, F, Sannio, F, Marcoccia, F, Docquier, J.D, Pozzi, C, Mangani, S.
Deposit date:2021-06-14
Release date:2021-10-20
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:1,2,4-Triazole-3-thione compounds with a 4-ethyl alkyl/aryl sulfide substituent are broad-spectrum metallo-beta-lactamase inhibitors with re-sensitization activity.
Eur.J.Med.Chem., 226, 2021

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