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4ARO
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BU of 4aro by Molmil
Hafnia Alvei phytase in complex with myo-inositol hexakis sulphate
Descriptor: D-MYO-INOSITOL-HEXASULPHATE, DI(HYDROXYETHYL)ETHER, HISTIDINE ACID PHOSPHATASE, ...
Authors:Moroz, O.V, Blagova, E.B, Ariza, A, Turkenburg, J.P, Vevodova, J, Roberts, S, Vind, J, Sjoholm, C, Lassen, S.F, De Maria, L, Glitsoe, V, Skov, L.K, Wilson, K.S.
Deposit date:2012-04-25
Release date:2013-05-08
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Degradation of Phytate by the 6-Phytase from Hafnia Alvei: A Combined Structural and Solution Study.
Plos One, 8, 2013
1OYU
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BU of 1oyu by Molmil
Long-Distance conformational changes in a protein engineered by modulated sequence duplication
Descriptor: Lysozyme
Authors:Sagermann, M, Gay, L, Matthews, B.W.
Deposit date:2003-04-07
Release date:2003-07-08
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Long-distance conformational changes in a protein engineered by modulated sequence duplication
Proc.Natl.Acad.Sci.USA, 100, 2003
8V32
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BU of 8v32 by Molmil
TnsD-TnsC-DNA complex
Descriptor: ADENOSINE-5'-TRIPHOSPHATE, DNA (41-MER), MAGNESIUM ION, ...
Authors:Chang, L, Wang, S.
Deposit date:2023-11-26
Release date:2024-10-16
Last modified:2024-10-23
Method:ELECTRON MICROSCOPY (3.01 Å)
Cite:Structure of TnsABCD transpososome reveals mechanisms of targeted DNA transposition.
Cell, 2024
8B32
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BU of 8b32 by Molmil
Chalcone synthase from Hordeum vulgare complexed with CoA
Descriptor: COENZYME A, Chalcone synthase 2
Authors:Zhang, L, Groves, M.R.
Deposit date:2022-09-15
Release date:2023-09-27
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Engineering a Plant Polyketide Synthase for the Biosynthesis of Methylated Flavonoids.
J.Agric.Food Chem., 72, 2024
1DZ5
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BU of 1dz5 by Molmil
The NMR structure of the 38KDa U1A protein-PIE RNA complex reveals the basis of cooperativity in regulation of polyadenylation by human U1A protein
Descriptor: PIE, RNA (5'-R(*GP*AP*GP*AP*CP*AP*UP*UP*GP*CP*AP*CP*CP* CP*GP*GP*AP*GP*UP*CP*UP*C)-3'), U1 SMALL NUCLEAR RIBONUCLEOPROTEIN A
Authors:Varani, L, Gunderson, S.I, Mattaj, I.W, Kay, L.E, Neuhaus, D, Varani, G.
Deposit date:2000-02-16
Release date:2000-03-29
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:The NMR Structure of the 38kDa U1A Protein-Pie RNA Complex Reveals the Basis of Cooperativity in Regulation of Polyadenylation by Human U1A Protein
Nat.Struct.Biol., 7, 2000
8U9L
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BU of 8u9l by Molmil
Crystal Structure of RelA-cRel chimera complex with DNA
Descriptor: DNA (5'-D(P*GP*AP*AP*TP*CP*GP*GP*AP*AP*AP*TP*TP*CP*CP*CP*AP*TP*CP*AP*A)-3'), DNA (5'-D(P*TP*TP*GP*AP*TP*GP*GP*GP*AP*AP*TP*TP*TP*CP*CP*GP*AP*TP*TP*C)-3'), Transcription factor p65,Proto-oncogene c-Rel chimera
Authors:Chang, A, Wu, Y, Li, S.X, Smale, S, Chen, L.
Deposit date:2023-09-19
Release date:2024-10-02
Method:X-RAY DIFFRACTION (3.091 Å)
Cite:Crystal Structure of RelA-cRel chimera complex with DNA
To Be Published
8B35
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BU of 8b35 by Molmil
Chalcone synthase from Hordeum vulgare complexed with CoA and naringenin
Descriptor: COENZYME A, Chalcone synthase 2, NARINGENIN
Authors:Zhang, L, Groves, M.R.
Deposit date:2022-09-15
Release date:2023-09-27
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:Engineering a Plant Polyketide Synthase for the Biosynthesis of Methylated Flavonoids.
J.Agric.Food Chem., 72, 2024
5NOB
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BU of 5nob by Molmil
Crystal structure of human tankyrase 2 in complex with OD336
Descriptor: 1-[3-[4-(2-chlorophenyl)-5-pyrimidin-4-yl-1,2,4-triazol-3-yl]cyclobutyl]-2-oxidanylidene-3~{H}-benzimidazole-5-carbonitrile, Tankyrase-2, ZINC ION
Authors:Ignatev, A, Lehtio, L.
Deposit date:2017-04-11
Release date:2017-11-29
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Discovery of a Novel Series of Tankyrase Inhibitors by a Hybridization Approach.
J. Med. Chem., 60, 2017
4B3U
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BU of 4b3u by Molmil
Pseudomonas aeruginosa RmlA in complex with allosteric inhibitor
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 6-amino-1-benzyl-5-(ethylamino)pyrimidine-2,4(1H,3H)-dione, CHLORIDE ION, ...
Authors:Alphey, M.S, Pirrie, L, Torrie, L.S, Gardiner, M, Sarkar, A, Brenk, R, Westwood, N.J, Gray, D, Naismith, J.H.
Deposit date:2012-07-26
Release date:2012-10-31
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Allosteric competitive inhibitors of the glucose-1-phosphate thymidylyltransferase (RmlA) from Pseudomonas aeruginosa.
ACS Chem. Biol., 8, 2013
8B3C
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BU of 8b3c by Molmil
Chalcone synthase from Hordeum vulgare complexed with CoA and eriodictyol
Descriptor: (2S)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE, COENZYME A, Chalcone synthase 2
Authors:Zhang, L, Groves, M.R.
Deposit date:2022-09-16
Release date:2023-09-27
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2 Å)
Cite:Engineering a Plant Polyketide Synthase for the Biosynthesis of Methylated Flavonoids.
J.Agric.Food Chem., 72, 2024
4AAW
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BU of 4aaw by Molmil
S.pneumoniae GlmU in complex with an antibacterial inhibitor
Descriptor: 4-{[1-(2-{[({5-[(3-carboxypropanoyl)amino]-2,4-dimethoxyphenyl}sulfonyl)amino]methyl}phenyl)piperidin-4-yl]methoxy}-4-oxobutanoic acid, BIFUNCTIONAL PROTEIN GLMU, SULFATE ION
Authors:Otterbein, L, Breed, J, Ogg, D.J.
Deposit date:2011-12-05
Release date:2012-02-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Inhibitors of Acetyltransferase Domain of N-Acetylglucosamine-1-Phosphate-Uridyltransferase/ Glucosamine-1-Phosphate-Acetyltransferase (Glmu). Part 1: Hit to Lead Evaluation of a Novel Arylsulfonamide Series.
Bioorg.Med.Chem.Lett., 22, 2012
8UF8
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BU of 8uf8 by Molmil
Cryo-EM structure of alpha-Klotho
Descriptor: Klotho
Authors:Schnicker, N.J, Xu, Z, Mohammad, A, Gakhar, L, Huang, C.L.
Deposit date:2023-10-03
Release date:2024-10-16
Method:ELECTRON MICROSCOPY (6.5 Å)
Cite:Exploring the a-Klotho conformational landscape
To Be Published
5N77
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BU of 5n77 by Molmil
Crystal structure of the cytosolic domain of the CorA magnesium channel from Escherichia coli in complex with magnesium
Descriptor: 2-(2-METHOXYETHOXY)ETHANOL, MAGNESIUM ION, Magnesium transport protein CorA
Authors:Lerche, M, Sandhu, H, Flockner, L, Hogbom, M, Rapp, M.
Deposit date:2017-02-20
Release date:2017-07-12
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structure and Cooperativity of the Cytosolic Domain of the CorA Mg(2+) Channel from Escherichia coli.
Structure, 25, 2017
1DQE
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BU of 1dqe by Molmil
BOMBYX MORI PHEROMONE BINDING PROTEIN
Descriptor: HEXADECA-10,12-DIEN-1-OL, PHEROMONE-BINDING PROTEIN
Authors:Sandler, B.H, Nikonova, L, Leal, W.S, Clardy, J.
Deposit date:2000-01-04
Release date:2001-01-10
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Sexual attraction in the silkworm moth: structure of the pheromone-binding-protein-bombykol complex.
Chem.Biol., 7, 2000
3W0I
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BU of 3w0i by Molmil
Crystal Structure of Rat VDR Ligand Binding Domain in Complex with Novel Nonsecosteroidal Ligands
Descriptor: (2S)-3-{4-[3-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}phenyl)pentan-3-yl]phenoxy}propane-1,2-diol, Mediator of RNA polymerase II transcription subunit 1, Vitamin D3 Receptor
Authors:Shimizu, T, Asano, L, Kuwabara, N, Ito, I, Waku, T, Yanagisawa, J, Miyachi, H.
Deposit date:2012-10-30
Release date:2013-10-09
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural basis for vitamin D receptor agonism by novel non-secosteroidal ligands.
Febs Lett., 587, 2013
6FW4
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BU of 6fw4 by Molmil
Protein-protein interactions and conformational changes : Importance of the hydrophobic cavity of TolA C-terminal domain
Descriptor: TolA protein
Authors:Navarro, R, van Heijenoort, C, Bornet, O, Houot, L, Lloubes, R, Guerlesquin, F, Nouailler, M.
Deposit date:2018-03-05
Release date:2019-03-20
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Induced fit conformational changes of Vibrio cholerae TolAIII domain during the complex formation with the viral PIIIN1 domain: Structural and High-pressure NMR studies.
To Be Published
8RUW
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BU of 8ruw by Molmil
Crystal structure of Archaeoglobus fulgidus (S)-3-O-geranylgeranylglyceryl phosphate synthase
Descriptor: Geranylgeranylglyceryl phosphate synthase, PHOSPHATE ION, SULFATE ION
Authors:Eilert, L, Blankenfeldt, W.
Deposit date:2024-01-31
Release date:2024-10-16
Method:X-RAY DIFFRACTION (2.48 Å)
Cite:Biocatalytic Ether Lipid Synthesis by an Archaeal Glycerolprenylase.
Angew.Chem.Int.Ed.Engl., 2024
4A29
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BU of 4a29 by Molmil
Structure of the engineered retro-aldolase RA95.0
Descriptor: 1-(6-METHOXYNAPHTHALEN-2-YL)BUTANE-1,3-DIONE, D-MALATE, ENGINEERED RETRO-ALDOL ENZYME RA95.0
Authors:Giger, L, Caner, S, Kast, P, Baker, D, Ban, N, Hilvert, D.
Deposit date:2011-09-23
Release date:2012-11-07
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Evolution of a designed retro-aldolase leads to complete active site remodeling.
Nat.Chem.Biol., 9, 2013
3V7V
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BU of 3v7v by Molmil
Thaumatin by Classical Hanging Drop Vapour Diffusion after 1.81 MGy X-Ray dose at ESRF ID29 beamline (Best Case)
Descriptor: GLYCEROL, Thaumatin I
Authors:Belmonte, L, Scudieri, D, Tripathi, S, Pechkova, E, Nicolini, C.
Deposit date:2011-12-22
Release date:2012-11-07
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Langmuir-Blodgett nanotemplate and radiation resistance in protein crystals: state of the art.
CRIT.REV.EUKARYOT.GENE EXPR., 22, 2012
8B5W
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BU of 8b5w by Molmil
Crystal structure of the E3 module from UBR4
Descriptor: 1,2-ETHANEDIOL, ZINC ION, cDNA FLJ12511 fis, ...
Authors:Virdee, S, Mabbitt, P.D, Barnsby-Greer, L.
Deposit date:2022-09-24
Release date:2023-10-04
Last modified:2024-04-17
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:UBE2A and UBE2B are recruited by an atypical E3 ligase module in UBR4.
Nat.Struct.Mol.Biol., 31, 2024
4A2R
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BU of 4a2r by Molmil
Structure of the engineered retro-aldolase RA95.5-5
Descriptor: 1-(6-METHOXYNAPHTHALEN-2-YL)BUTANE-1,3-DIONE, INDOLE-3-GLYCEROL PHOSPHATE SYNTHASE
Authors:Giger, L, Caner, S, Kast, P, Baker, D, Ban, N, Hilvert, D.
Deposit date:2011-09-28
Release date:2012-11-07
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.302 Å)
Cite:Evolution of a designed retro-aldolase leads to complete active site remodeling.
Nat.Chem.Biol., 9, 2013
4A3R
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BU of 4a3r by Molmil
Crystal structure of Enolase from Bacillus subtilis.
Descriptor: CITRIC ACID, ENOLASE, SODIUM ION
Authors:Newman, J.A, Hewitt, L, Rodrigues, C, Solovyova, A.S, Harwood, C.R, Lewis, R.J.
Deposit date:2011-10-04
Release date:2012-08-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Dissection of the Network of Interactions that Links RNA Processing with Glycolysis in the Bacillus Subtilis Degradosome.
J.Mol.Biol., 416, 2012
4A3S
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BU of 4a3s by Molmil
Crystal structure of PFK from Bacillus subtilis
Descriptor: 6-PHOSPHOFRUCTOKINASE
Authors:Newman, J.A, Hewitt, L, Rodrigues, C, Solovyova, A.S, Harwood, C.R, Lewis, R.J.
Deposit date:2011-10-04
Release date:2012-08-15
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Dissection of the Network of Interactions that Links RNA Processing with Glycolysis in the Bacillus Subtilis Degradosome.
J.Mol.Biol., 416, 2012
8B6M
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BU of 8b6m by Molmil
Tankyrase 2 in complex with an inhibitor
Descriptor: GLYCEROL, Poly [ADP-ribose] polymerase tankyrase-2, SULFATE ION, ...
Authors:Bosetti, C, Sowa, S.T, Lehtio, L.
Deposit date:2022-09-27
Release date:2023-10-11
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Tankyrase 2 in complex with an inhibitor
To Be Published
5YL9
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BU of 5yl9 by Molmil
1.86 Angstrom crystal structure of human Coronavirus 229E fusion core
Descriptor: Spike glycoprotein
Authors:Yang, B, Yan, L, Meng, B, WIlson, I.A.
Deposit date:2017-10-17
Release date:2018-09-26
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.861 Å)
Cite:Crystal structure of the post-fusion core of the Human coronavirus 229E spike protein at 1.86 angstrom resolution
Acta Crystallogr D Struct Biol, 74, 2018

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