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2JGM
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BU of 2jgm by Molmil
Crystal structure of mouse acetylcholinesterase inhibited by aged diisopropyl fluorophosphate (DFP)
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETYLCHOLINESTERASE
Authors:Hornberg, A, Tunemalm, A.-K, Ekstrom, F.
Deposit date:2007-02-13
Release date:2007-04-17
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Crystal Structures of Acetylcholinesterase in Complex with Organophosphorus Compounds Suggest that the Acyl Pocket Modulates the Aging Reaction by Precluding the Formation of the Trigonal Bipyramidal Transition State.
Biochemistry, 46, 2007
2JKG
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BU of 2jkg by Molmil
Plasmodium falciparum profilin
Descriptor: MAGNESIUM ION, OCTAPROLINE PEPTIDE, PROFILIN
Authors:Kursula, I, Kursula, P, Ganter, M, Panjikar, S, Matuschewski, K, Schueler, H.
Deposit date:2008-08-28
Release date:2008-09-23
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Structural Basis for Parasite-Specific Functions of the Divergent Profilin of Plasmodium Falciparum.
Structure, 16, 2008
2JAU
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Crystal structure of D41N variant of human mitochondrial 5'(3')- deoxyribonucleotidase (mdN) in complex with 3'-azidothymidine 5'- monophosphate
Descriptor: 3'-AZIDO-3'-DEOXYTHYMIDINE-5'-MONOPHOSPHATE, 5'(3')-DEOXYRIBONUCLEOTIDASE, MAGNESIUM ION, ...
Authors:Wallden, K, Ruzzenente, B, Bianchi, V, Nordlund, P.
Deposit date:2006-11-30
Release date:2007-12-11
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal Structures of Human and Murine Deoxyribonucleotidases: Insights Into Recognition of Substrates and Nucleotide Analogues.
Biochemistry, 46, 2007
2JKF
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Plasmodium falciparum profilin
Descriptor: PROFILIN
Authors:Kursula, I, Kursula, P, Ganter, M, Panjikar, S, Matuschewski, K, Schueler, H.
Deposit date:2008-08-28
Release date:2008-09-23
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.31 Å)
Cite:Structural Basis for Parasite-Specific Functions of the Divergent Profilin of Plasmodium Falciparum
Structure, 16, 2008
6OHD
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BU of 6ohd by Molmil
P38 in complex with T-3220137
Descriptor: 3-(3-tert-butyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-6-yl)-4-methyl-N-(1,2-oxazol-3-yl)benzamide, Mitogen-activated protein kinase 14
Authors:Lane, W, Saikatendu, K.
Deposit date:2019-04-05
Release date:2019-11-20
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure-Based Design, Synthesis, and Biological Evaluation of Imidazo[4,5-b]Pyridin-2-one-Based p38 MAP Kinase Inhibitors: Part 2.
Chemmedchem, 14, 2019
3P0R
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BU of 3p0r by Molmil
Crystal structure of azoreductase from Bacillus anthracis str. Sterne
Descriptor: Azoreductase, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Filippova, E.V, Wawrzak, Z, Kudritska, M, Edwards, A, Savchenko, A, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID)
Deposit date:2010-09-29
Release date:2010-10-20
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (1.799 Å)
Cite:Crystal structure of azoreductase from Bacillus anthracis str. Sterne
To be Published
8R36
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BU of 8r36 by Molmil
Crystal structure of the Gluk1 ligand-binding domain in complex with kainate and BPAM538 at 1.90 A resolution
Descriptor: 3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE, 4-cyclopropyl-7-(3-methoxyphenoxy)-2,3-dihydro-1$l^{6},2,4-benzothiadiazine 1,1-dioxide, CHLORIDE ION, ...
Authors:Bay, Y, Frantsen, S.M, Frydenvang, K, Kastrup, J.S.
Deposit date:2023-11-08
Release date:2024-08-14
Last modified:2024-09-04
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of the GluK1 ligand-binding domain with kainate and the full-spanning positive allosteric modulator BPAM538.
J.Struct.Biol., 216, 2024
8R32
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BU of 8r32 by Molmil
Crystal structure of the GluK2 ligand-binding domain in complex with L-glutamate and BPAM344 at 1.60 A resolution
Descriptor: 4-cyclopropyl-7-fluoro-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide, CHLORIDE ION, GLUTAMIC ACID, ...
Authors:Bay, Y, Jeppesen, M.E, Frydenvang, K, Kastrup, J.S.
Deposit date:2023-11-08
Release date:2024-09-18
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The positive allosteric modulator BPAM344 and L-glutamate introduce an active-like structure of the ligand-binding domain of GluK2.
Febs Lett., 598, 2024
1XGV
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Isocitrate Dehydrogenase from the hyperthermophile Aeropyrum pernix
Descriptor: Isocitrate dehydrogenase
Authors:Karlstrom, M, Stokke, R, Steen, I.H, Birkeland, N.-K, Ladenstein, R.
Deposit date:2004-09-17
Release date:2005-09-20
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Isocitrate dehydrogenase from the hyperthermophile Aeropyrum pernix: X-ray structure analysis of a ternary enzyme-substrate complex and thermal stability
J.Mol.Biol., 345, 2005
1ZOR
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Isocitrate dehydrogenase from the hyperthermophile Thermotoga maritima
Descriptor: SODIUM ION, isocitrate dehydrogenase
Authors:Karlstrom, M, Steen, I.H, Birkeland, N.-K, Ladenstein, R.
Deposit date:2005-05-13
Release date:2006-05-16
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.24 Å)
Cite:The crystal structure of a hyperthermostable subfamily II isocitrate dehydrogenase from Thermotoga maritima.
Febs J., 273, 2006
8Z62
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BU of 8z62 by Molmil
Crystal structure of rRNA (uracil-C5)-methyltransferase from Pyrococcus horikoshii OT3
Descriptor: 1,2-ETHANEDIOL, 23S rRNA (uracil(747)-C(5))-methyltransferase, DI(HYDROXYETHYL)ETHER, ...
Authors:Saha, S, Kanaujia, S.P.
Deposit date:2024-04-18
Release date:2024-10-16
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Decoding Substrate Selectivity of an Archaeal RlmCD-like Methyltransferase Through Its Salient Traits.
Biochemistry, 63, 2024
1Z43
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BU of 1z43 by Molmil
Crystal structure of 7S.S SRP RNA of M. jannaschii
Descriptor: RNA (101-MER)
Authors:Hainzl, T, Huang, S, Sauer-Eriksson, A.E.
Deposit date:2005-03-15
Release date:2005-06-14
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Structural insights into SRP RNA: An induced fit mechanism for SRP assembly
Rna, 11, 2005
2DJF
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BU of 2djf by Molmil
Crystal Structure of human dipeptidyl peptidase I (Cathepsin C) in complex with the inhibitor Gly-Phe-CHN2
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETIC ACID, CHLORIDE ION, ...
Authors:Molgaard, A, Arnau, J, Lauritzen, C, Larsen, S, Petersen, G, Pedersen, J.
Deposit date:2006-04-02
Release date:2006-11-14
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2 Å)
Cite:The crystal structure of human dipeptidyl peptidase I (cathepsin C) in complex with the inhibitor Gly-Phe-CHN2
Biochem.J., 401, 2007
2DWT
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BU of 2dwt by Molmil
Cu-containing nitrite reductase at pH 6.0 with bound nitrite
Descriptor: COPPER (II) ION, Copper-containing nitrite reductase, NITRITE ION
Authors:Jacobson, F.
Deposit date:2006-08-17
Release date:2006-12-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:pH Dependence of Copper Geometry, Reduction Potential, and Nitrite Affinity in Nitrite Reductase
J.Biol.Chem., 282, 2007
2A5V
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BU of 2a5v by Molmil
Crystal structure of M. tuberculosis beta carbonic anhydrase, Rv3588c, tetrameric form
Descriptor: CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE), THIOCYANATE ION, ZINC ION
Authors:Covarrubias, A.S, Bergfors, T, Jones, T.A, Hogbom, M.
Deposit date:2005-07-01
Release date:2005-09-20
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural Mechanics of the pH-dependent Activity of beta-Carbonic Anhydrase from Mycobacterium tuberculosis
J.Biol.Chem., 281, 2006
2DY2
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BU of 2dy2 by Molmil
Nitrite reductase pH 6.0
Descriptor: COPPER (II) ION, Copper-containing nitrite reductase
Authors:Jacobson, F.
Deposit date:2006-09-05
Release date:2006-12-05
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:pH Dependence of Copper Geometry, Reduction Potential, and Nitrite Affinity in Nitrite Reductase
J.Biol.Chem., 282, 2007
1XJK
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BU of 1xjk by Molmil
Structural mechanism of allosteric substrate specificity in a ribonucleotide reductase: dGTP-ADP complex
Descriptor: 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE, ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ...
Authors:Larsson, K.-M, Jordan, A, Eliasson, R, Reichard, P, Logan, D.T, Nordlund, P.
Deposit date:2004-09-23
Release date:2005-11-22
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:Structural mechanism of allosteric substrate specificity regulation in a ribonucleotide reductase.
Nat.Struct.Mol.Biol., 11, 2004
2OLY
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BU of 2oly by Molmil
Structure of human insulin in presence of urea at pH 7.0
Descriptor: CHLORIDE ION, GLYCEROL, Insulin A chain, ...
Authors:Norrman, M, Schluckebier, G.
Deposit date:2007-01-20
Release date:2007-12-04
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystallographic characterization of two novel crystal forms of human insulin induced by chaotropic agents and a shift in pH.
Bmc Struct.Biol., 7, 2007
1ZV2
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BU of 1zv2 by Molmil
Cu-containing nitrite reductase
Descriptor: COPPER (II) ION, Copper-containing nitrite reductase, MAGNESIUM ION
Authors:Jacobson, F, Guo, H, Olesen, K, Okvist, M, Neutze, R, Sjolin, L.
Deposit date:2005-06-01
Release date:2005-06-21
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Structures of the oxidized and reduced forms of nitrite reductase from Rhodobacter sphaeroides 2.4.3 at high pH: changes in the interactions of the type 2 copper.
Acta Crystallogr.,Sect.D, 61, 2005
2OYA
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BU of 2oya by Molmil
Crystal structure analysis of the dimeric form of the SRCR domain of mouse MARCO
Descriptor: Macrophage receptor MARCO, SULFATE ION
Authors:Ojala, J.R.M, Pikkarainen, T, Tuuttila, A, Sandalova, T, Tryggvason, K.
Deposit date:2007-02-21
Release date:2007-04-17
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Crystal structure of the cysteine-rich domain of scavenger receptor MARCO reveals the presence of a basic and an acidic cluster that both contribute to ligand recognition.
J.Biol.Chem., 282, 2007
2OMH
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BU of 2omh by Molmil
Structure of human insulin cocrystallized with ARG-12 peptide in presence of urea
Descriptor: CHLORIDE ION, FORMAMIDE, Insulin A chain, ...
Authors:Norrman, M, Schluckebier, G.
Deposit date:2007-01-22
Release date:2007-03-27
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.36 Å)
Cite:Structural characterization of insulin NPH formulations.
EUR.J.PHARM.SCI., 30, 2007
2OM1
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BU of 2om1 by Molmil
Structure of human insulin in presence of thiocyanate at pH 6.5
Descriptor: GLYCEROL, Insulin A chain, Insulin B chain, ...
Authors:Norrman, M, Schluckebier, G.
Deposit date:2007-01-20
Release date:2007-12-04
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Crystallographic characterization of two novel crystal forms of human insulin induced by chaotropic agents and a shift in pH.
Bmc Struct.Biol., 7, 2007
2OO0
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BU of 2oo0 by Molmil
A structural insight into the inhibition of human and Leishmania donovani ornithine decarboxylases by 3-aminooxy-1-aminopropane
Descriptor: 3-AMINOOXY-1-AMINOPROPANE, ACETATE ION, Ornithine decarboxylase, ...
Authors:Dufe, V.T, Ingner, D, Khomutov, A.R, Heby, O, Persson, L, Al-Karadaghi, S.
Deposit date:2007-01-25
Release date:2007-07-17
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A structural insight into the inhibition of human and Leishmania donovani ornithine decarboxylases by 1-amino-oxy-3-aminopropane.
Biochem.J., 405, 2007
1XSE
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BU of 1xse by Molmil
Crystal Structure of Guinea Pig 11beta-Hydroxysteroid Dehydrogenase Type 1
Descriptor: 11beta-hydroxysteroid dehydrogenase type 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Ogg, D, Elleby, B, Norstrom, C, Stefansson, K, Abrahmsen, L, Oppermann, U, Svensson, S.
Deposit date:2004-10-19
Release date:2004-11-16
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:The crystal structure of guinea pig 11beta-hydroxysteroid dehydrogenase type 1 provides a model for enzyme-lipid bilayer interactions
J.Biol.Chem., 280, 2005
2EPO
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BU of 2epo by Molmil
N-acetyl-B-D-glucosaminidase (GCNA) from Streptococcus gordonii
Descriptor: ACETIC ACID, N-acetyl-beta-D-glucosaminidase
Authors:Langley, D.B.
Deposit date:2007-03-30
Release date:2008-03-11
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Structure of N-acetyl-beta-D-glucosaminidase (GcnA) from the Endocarditis Pathogen Streptococcus gordonii and its Complex with the Mechanism-based Inhibitor NAG-thiazoline
J.Mol.Biol., 377, 2008

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