6FVG
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![BU of 6fvg by Molmil](/molmil-images/mine/6fvg) | The Structure of CK2alpha with CCh507 bound | Descriptor: | ADENOSINE-5'-TRIPHOSPHATE, Casein kinase II subunit alpha, [1-[2-(phenylsulfonylamino)ethyl]piperidin-4-yl]methyl 1~{H}-indole-3-carboxylate | Authors: | Brear, P, Prudent, R, Laudet, B, Filhol, O, Cochet, C, Sautel, C, Moucadel, V, Bestgen, B, Engel, M, Ettaoussi, M, Lomberget, T, Le Borgne, M, Kufareva, I, Abagyan, R, Hyvonen, M. | Deposit date: | 2018-03-02 | Release date: | 2019-06-19 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Discovery of holoenzyme-disrupting chemicals as substrate-selective CK2 inhibitors. Sci Rep, 9, 2019
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3E1T
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![BU of 3e1t by Molmil](/molmil-images/mine/3e1t) | Structure and action of the myxobacterial chondrochloren halogenase CndH, a new variant of FAD-dependent halogenases | Descriptor: | CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, Halogenase | Authors: | Buedenbender, S, Rachid, S, Mueller, R, Schulz, G.E. | Deposit date: | 2008-08-04 | Release date: | 2009-02-24 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (2.05 Å) | Cite: | Structure and action of the myxobacterial chondrochloren halogenase CndH: a new variant of FAD-dependent halogenases. J.Mol.Biol., 385, 2009
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5OF9
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![BU of 5of9 by Molmil](/molmil-images/mine/5of9) | Crystal structure of human MORC2 (residues 1-603) | Descriptor: | MAGNESIUM ION, MORC family CW-type zinc finger protein 2, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ... | Authors: | Douse, C.H, Shamin, M, Modis, Y. | Deposit date: | 2017-07-10 | Release date: | 2018-02-14 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.807 Å) | Cite: | Neuropathic MORC2 mutations perturb GHKL ATPase dimerization dynamics and epigenetic silencing by multiple structural mechanisms. Nat Commun, 9, 2018
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5CA9
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5CFU
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![BU of 5cfu by Molmil](/molmil-images/mine/5cfu) | Crystal Structure of ANT(2")-Ia in complex with adenylyl-2"-tobramycin | Descriptor: | 1,4-BUTANEDIOL, Aminoglycoside Nucleotidyltransferase (2")-Ia, MANGANESE (II) ION, ... | Authors: | Rodionov, D, Bassenden, A.V, Berghuis, A.M. | Deposit date: | 2015-07-08 | Release date: | 2016-07-20 | Last modified: | 2023-09-27 | Method: | X-RAY DIFFRACTION (1.82 Å) | Cite: | Revisiting the Catalytic Cycle and Kinetic Mechanism of AminoglycosideO-Nucleotidyltransferase(2′′): A Structural and Kinetic Study. Acs Chem.Biol., 2020
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3NCM
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![BU of 3ncm by Molmil](/molmil-images/mine/3ncm) | NEURAL CELL ADHESION MOLECULE, MODULE 2, NMR, 20 STRUCTURES | Descriptor: | PROTEIN (NEURAL CELL ADHESION MOLECULE, LARGE ISOFORM) | Authors: | Jensen, P.H, Soroka, V, Thomsen, N.K, Berezin, V, Bock, E, Poulsen, F.M. | Deposit date: | 1998-09-21 | Release date: | 1999-07-23 | Last modified: | 2023-12-27 | Method: | SOLUTION NMR | Cite: | Structure and interactions of NCAM modules 1 and 2, basic elements in neural cell adhesion Nat.Struct.Biol., 6, 1999
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3DYE
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![BU of 3dye by Molmil](/molmil-images/mine/3dye) | Crystal structure of AED7-norepineprhine complex | Descriptor: | BROMIDE ION, D7 protein, GLYCEROL, ... | Authors: | Andersen, J.F, Calvo, E, Mans, B.J, Ribeiro, J.M. | Deposit date: | 2008-07-27 | Release date: | 2009-02-03 | Last modified: | 2021-03-31 | Method: | X-RAY DIFFRACTION (1.75 Å) | Cite: | Multifunctionality and mechanism of ligand binding in a mosquito antiinflammatory protein Proc.Natl.Acad.Sci.USA, 106, 2009
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3DJP
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![BU of 3djp by Molmil](/molmil-images/mine/3djp) | Bovine Seminal Ribonuclease- Uridine 3' phosphate complex | Descriptor: | Seminal ribonuclease, URACIL ARABINOSE-3'-PHOSPHATE | Authors: | Dossi, K, Leonidas, D.D, Zographos, S.E, Oikonomakos, N.G. | Deposit date: | 2008-06-24 | Release date: | 2009-06-30 | Last modified: | 2023-11-01 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Mapping the ribonucleolytic active site of bovine seminal ribonuclease. The binding of pyrimidinyl phosphonucleotide inhibitors Eur.J.Med.Chem., 44, 2009
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1PU6
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![BU of 1pu6 by Molmil](/molmil-images/mine/1pu6) | Crystal structure of H.pylori 3-methyladenine DNA glycosylase (MagIII) | Descriptor: | (4S)-2-METHYL-2,4-PENTANEDIOL, 3-METHYLADENINE DNA GLYCOSYLASE, BETA-MERCAPTOETHANOL, ... | Authors: | Eichman, B.F, O'Rourke, E.J, Radicella, J.P, Ellenberger, T. | Deposit date: | 2003-06-24 | Release date: | 2003-10-07 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.64 Å) | Cite: | Crystal structures of 3-methyladenine DNA glycosylase MagIII and the recognition of alkylated bases Embo J., 22, 2003
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7JWX
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![BU of 7jwx by Molmil](/molmil-images/mine/7jwx) | Crystal Structure of Trypsin Bound O-methyl Benzamidine | Descriptor: | 4-[(1-{(1S,2S)-1-[1-(4-aminobutyl)-1H-1,2,3-triazol-4-yl]-2-methylbutyl}-1H-1,2,3-triazol-4-yl)methoxy]-3-methoxybenzene-1-carboximidamide, CALCIUM ION, CHLORIDE ION, ... | Authors: | Packianathan, C, Laganowsky, A. | Deposit date: | 2020-08-26 | Release date: | 2021-08-04 | Last modified: | 2023-10-18 | Method: | X-RAY DIFFRACTION (2.38 Å) | Cite: | Small molecule peptidomimetic trypsin inhibitors: validation of an EKO binding mode, but with a twist. Org.Biomol.Chem., 20, 2022
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5CA8
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1Q35
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![BU of 1q35 by Molmil](/molmil-images/mine/1q35) | Crystal Structure of Pasteurella haemolytica Apo Ferric ion-Binding Protein A | Descriptor: | 1,2-ETHANEDIOL, FORMIC ACID, iron binding protein FbpA | Authors: | Shouldice, S.R, Dougan, D.R, Skene, R.J, Snell, G, Scheibe, D, Williams, P.A, Kirby, S, McRee, D.E, Schryvers, A.B, Tari, L.W. | Deposit date: | 2003-07-28 | Release date: | 2003-11-11 | Last modified: | 2011-07-13 | Method: | X-RAY DIFFRACTION (1.2 Å) | Cite: | Crystal structure of Pasteurella haemolytica ferric ion-binding protein A reveals a novel class of bacterial iron-binding proteins J.Biol.Chem., 278, 2003
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7JT8
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![BU of 7jt8 by Molmil](/molmil-images/mine/7jt8) | Apo structure of a pseudomurein peptide ligase type E from Methanothermus fervidus | Descriptor: | MAGNESIUM ION, Mur ligase middle domain protein, SULFATE ION | Authors: | Carbone, V, Schofield, L.R, Sutherland-Smith, A.J, Ronimus, R.S, Subedi, B.P. | Deposit date: | 2020-08-17 | Release date: | 2021-09-01 | Last modified: | 2023-10-25 | Method: | X-RAY DIFFRACTION (1.84 Å) | Cite: | Structural characterisation of methanogen pseudomurein cell wall peptide ligases homologous to bacterial MurE/F murein peptide ligases. Microbiology (Reading, Engl.), 168, 2022
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2JC9
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![BU of 2jc9 by Molmil](/molmil-images/mine/2jc9) | Crystal structure of Human Cytosolic 5'-Nucleotidase II in complex with adenosine | Descriptor: | ADENOSINE, CYTOSOLIC PURINE 5'-NUCLEOTIDASE, GLYCEROL, ... | Authors: | Wallden, K, Stenmark, P, Arrowsmith, C, Berglund, H, Busam, R, Collins, R, Edwards, A, Ehn, M, Flodin, S, Flores, A, Graslund, S, Hammarstrom, M, Hallberg, B.M, Holmberg, S.L, Hogbom, M, Karlberg, T, Kotenyova, T, Magnusdottir, A, Nilsson-Ehle, P, Nyman, T, Ogg, D, Persson, C, Sagemark, J, Sundstrom, M, Uppenberg, J, Thorsell, A.G, Van Den Berg, S, Loppnau, P, Weigelt, J, Welin, M, Nordlund, P. | Deposit date: | 2006-12-21 | Release date: | 2007-01-02 | Last modified: | 2023-12-13 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | Crystal Structure of Human Cytosolic 5'-Nucleotidase II: Insights Into Allosteric Regulation and Substrate Recognition J.Biol.Chem., 282, 2007
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1PU7
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![BU of 1pu7 by Molmil](/molmil-images/mine/1pu7) | Crystal structure of H.pylori 3-methyladenine DNA glycosylase (MagIII) bound to 3,9-dimethyladenine | Descriptor: | 3-METHYLADENINE DNA GLYCOSYLASE, 6-AMINO-3,9-DIMETHYL-9H-PURIN-3-IUM, BETA-MERCAPTOETHANOL | Authors: | Eichman, B.F, O'Rourke, E.J, Radicella, J.P, Ellenberger, T. | Deposit date: | 2003-06-24 | Release date: | 2003-10-07 | Last modified: | 2023-11-15 | Method: | X-RAY DIFFRACTION (1.93 Å) | Cite: | Crystal structures of 3-methyladenine DNA glycosylase MagIII and the recognition of alkylated bases Embo J., 22, 2003
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3P2S
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![BU of 3p2s by Molmil](/molmil-images/mine/3p2s) | Crystal structure of the fluoroacetyl-CoA-specific thioesterase FlK in an open conformation | Descriptor: | Fluoroacetyl coenzyme A thioesterase | Authors: | Weeks, A.M, Coyle, S.M, Jinek, M, Doudna, J.A, Chang, M.C.Y. | Deposit date: | 2010-10-04 | Release date: | 2010-10-20 | Last modified: | 2011-11-16 | Method: | X-RAY DIFFRACTION (1.95 Å) | Cite: | Structural and biochemical studies of a fluoroacetyl-CoA-specific thioesterase reveal a molecular basis for fluorine selectivity. Biochemistry, 49, 2010
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1NY7
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![BU of 1ny7 by Molmil](/molmil-images/mine/1ny7) | COWPEA MOSAIC VIRUS (CPMV) | Descriptor: | COWPEA MOSAIC VIRUS, LARGE (L) SUBUNIT, SMALL (S) SUBUNIT | Authors: | Lin, T, Chen, Z, Usha, R, Stauffacher, C.V, Dai, J.-B, Schmidt, T, Johnson, J.E. | Deposit date: | 2003-02-11 | Release date: | 2003-03-18 | Last modified: | 2017-10-11 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | The Refined Crystal Structure of Cowpea Mosaic Virus at 2.8A Resolution Virology, 265, 1999
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3FTT
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![BU of 3ftt by Molmil](/molmil-images/mine/3ftt) | Crystal Structure of the galactoside O-acetyltransferase from Staphylococcus aureus | Descriptor: | Putative acetyltransferase SACOL2570 | Authors: | Knapik, A.A, Shumilin, I.A, Cui, H, Xu, X, Chruszcz, M, Zimmerman, M.D, Cymborowski, M, Anderson, W.F, Savchenko, A, Minor, W, Center for Structural Genomics of Infectious Diseases (CSGID) | Deposit date: | 2009-01-13 | Release date: | 2009-03-03 | Last modified: | 2022-04-13 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Biophysical analysis of the putative acetyltransferase SACOL2570 from methicillin-resistant Staphylococcus aureus. J.Struct.Funct.Genom., 14, 2013
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3FRK
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![BU of 3frk by Molmil](/molmil-images/mine/3frk) | X-ray structure of QdtB from T. thermosaccharolyticum in complex with a PLP:TDP-3-aminoquinovose aldimine | Descriptor: | (2R,3R,4S,5S,6R)-3,5-dihydroxy-4-{[(1E)-{3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene]amino}-6-methyltetrahydro-2H-pyran-2-yl [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl dihydrogen diphosphate, QdtB | Authors: | Thoden, J.B, Holden, H.M. | Deposit date: | 2009-01-08 | Release date: | 2009-02-17 | Last modified: | 2023-09-06 | Method: | X-RAY DIFFRACTION (2.15 Å) | Cite: | Structural analysis of QdtB, an aminotransferase required for the biosynthesis of dTDP-3-acetamido-3,6-dideoxy-alpha-D-glucose. Biochemistry, 48, 2009
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3FSY
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![BU of 3fsy by Molmil](/molmil-images/mine/3fsy) | Structure of tetrahydrodipicolinate N-succinyltransferase (Rv1201c;DapD) in complex with succinyl-CoA from Mycobacterium tuberculosis | Descriptor: | (4S)-2-METHYL-2,4-PENTANEDIOL, ACETIC ACID, MAGNESIUM ION, ... | Authors: | Schuldt, L, Weyand, S, Kefala, G, Weiss, M.S. | Deposit date: | 2009-01-12 | Release date: | 2009-06-23 | Last modified: | 2024-02-21 | Method: | X-RAY DIFFRACTION (1.97 Å) | Cite: | The three-dimensional Structure of a mycobacterial DapD provides insights into DapD diversity and reveals unexpected particulars about the enzymatic mechanism. J.Mol.Biol., 389, 2009
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6FVF
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![BU of 6fvf by Molmil](/molmil-images/mine/6fvf) | The Structure of CK2alpha with CCh503 bound | Descriptor: | ADENOSINE-5'-TRIPHOSPHATE, Casein kinase II subunit alpha, [1-[2-(phenylsulfonylamino)ethyl]piperidin-4-yl]methyl 5-fluoranyl-2-methoxy-1~{H}-indole-3-carboxylate | Authors: | Brear, P, Prudent, R, Laudet, B, Filhol, O, Cochet, C, Sautel, C, Moucadel, V, Bestgen, B, Engel, M, Ettaoussi, M, Lomberget, T, Le Borgne, M, Kufareva, I, Abagyan, R, Hyvonen, M. | Deposit date: | 2018-03-02 | Release date: | 2019-06-19 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.47 Å) | Cite: | Discovery of holoenzyme-disrupting chemicals as substrate-selective CK2 inhibitors. Sci Rep, 9, 2019
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2O3B
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![BU of 2o3b by Molmil](/molmil-images/mine/2o3b) | Crystal structure complex of Nuclease A (NucA) with intra-cellular inhibitor NuiA | Descriptor: | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, MAGNESIUM ION, NICKEL (II) ION, ... | Authors: | Ghosh, M, Meiss, G, Pingoud, A.M, London, R.E, Pedersen, L.C. | Deposit date: | 2006-12-01 | Release date: | 2006-12-19 | Last modified: | 2023-08-30 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | The nuclease a-inhibitor complex is characterized by a novel metal ion bridge. J.Biol.Chem., 282, 2007
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5CTG
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![BU of 5ctg by Molmil](/molmil-images/mine/5ctg) | The 3.1 A resolution structure of a eukaryotic SWEET transporter | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, Bidirectional sugar transporter SWEET2b, ... | Authors: | Tao, Y, Perry, K, Feng, L. | Deposit date: | 2015-07-24 | Release date: | 2015-10-28 | Last modified: | 2024-03-06 | Method: | X-RAY DIFFRACTION (3.103 Å) | Cite: | Structure of a eukaryotic SWEET transporter in a homotrimeric complex. Nature, 527, 2015
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5CTH
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![BU of 5cth by Molmil](/molmil-images/mine/5cth) | The 3.7 A resolution structure of a eukaryotic SWEET transporter | Descriptor: | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, Bidirectional sugar transporter SWEET2b, ... | Authors: | Feng, L, Tao, Y, Perry, K. | Deposit date: | 2015-07-24 | Release date: | 2015-10-28 | Last modified: | 2024-03-06 | Method: | X-RAY DIFFRACTION (3.69 Å) | Cite: | Structure of a eukaryotic SWEET transporter in a homotrimeric complex. Nature, 527, 2015
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1Z5G
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![BU of 1z5g by Molmil](/molmil-images/mine/1z5g) | Crystal structure of Salmonella typhimurium AphA protein | Descriptor: | AphA protein, MAGNESIUM ION, PHOSPHATE ION | Authors: | Makde, R.D, Kumar, V. | Deposit date: | 2005-03-18 | Release date: | 2006-03-21 | Last modified: | 2023-10-25 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Structural and mutational analyses reveal the functional role of active-site Lys-154 and Asp-173 of Salmonella typhimurium AphA protein. Arch.Biochem.Biophys., 464, 2007
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