PDB: 238582 resultsInfo pagesStatus searchChemie searchBIRD

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3SMP	Monoclinic crystal structure of human pantothenate kinase 1 alpha Descriptor: ACETYL COENZYME *A, ARSENIC, CHLORIDE ION, ... Authors: Guan, X, Tempel, W, Hong, B, Wernimont, A.K, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Park, H, Structural Genomics Consortium (SGC) Deposit date: 2011-06-28 Release date: 2011-07-20 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Monoclinic crystal structure of human pantothenate kinase 1 alpha to be published
3SNH	Crystal structure of nucleotide-free human dynamin1 Descriptor: Dynamin-1 Authors: Faelber, K, Daumke, O. Deposit date: 2011-06-29 Release date: 2011-09-21 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (3.7 Å) Cite: Crystal structure of nucleotide-free dynamin. Nature, 477, 2011
3S3B	Structure of Thermus thermophilus cytochrome ba3 oxidase 240s after Xe depressurization Descriptor: COPPER (II) ION, Cytochrome c oxidase polypeptide 2A, Cytochrome c oxidase subunit 1, ... Authors: Luna, V.M, Fee, J.A, Deniz, A.A, Stout, C.D. Deposit date: 2011-05-18 Release date: 2012-05-23 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Mobility of Xe atoms within the oxygen diffusion channel of cytochrome ba(3) oxidase. Biochemistry, 51, 2012
3S4K	Structure of a putative esterase Rv1847/MT1895 from Mycobacterium tuberculosis Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Putative esterase Rv1847/MT1895, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2011-05-19 Release date: 2011-06-01 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Structure of a putative esterase Rv1847/MT1895 from Mycobacterium tuberculosis To be Published
3S4S	Crystal structure of CD4 mutant bound to HLA-DR1 Descriptor: GLYCEROL, HLA class II histocompatibility antigen, DR alpha chain, ... Authors: Li, Y. Deposit date: 2011-05-20 Release date: 2011-09-21 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Affinity maturation of human CD4 by yeast surface display and crystal structure of a CD4-HLA-DR1 complex. Proc.Natl.Acad.Sci.USA, 108, 2011
3S73	The origin of the hydrophobic effect in the molecular recognition of arylsulfonamides by carbonic anhydrase Descriptor: 1,3-benzothiazole-2-sulfonamide, Carbonic anhydrase 2, ZINC ION Authors: Snyder, P.W, Heroux, A, Whitesides, G.W. Deposit date: 2011-05-26 Release date: 2011-12-21 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Mechanism of the hydrophobic effect in the biomolecular recognition of arylsulfonamides by carbonic anhydrase. Proc.Natl.Acad.Sci.USA, 108, 2011
3S6B	Crystal structure of methionine aminopeptidase 1b from Plasmodium Falciparum, PF10_0150 Descriptor: FE (III) ION, GLYCEROL, Methionine aminopeptidase Authors: Wernimont, A.K, Artz, J.D, Crombet, L, Lew, J, Weadge, J, Tempel, W, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Bountra, C, Hui, R, Hills, T, Structural Genomics Consortium (SGC) Deposit date: 2011-05-25 Release date: 2011-06-29 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Crystal structure of methionine aminopeptidase 1b from Plasmodium Falciparum, PF10_0150 To be Published
3S86	Crystal Structure of TM0159 with bound IMP Descriptor: INOSINIC ACID, Nucleoside-triphosphatase, SULFATE ION Authors: Sommerhalter, M, Smith, C, Awwad, K, Desai, A. Deposit date: 2011-05-27 Release date: 2012-06-06 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Structural and functional characterization of a noncanonical nucleoside triphosphate pyrophosphatase from Thermotoga maritima. Acta Crystallogr.,Sect.D, 69, 2013
3S71	The origin of the hydrophobic effect in the molecular recognition of arylsulfonamides by carbonic anhydrase Descriptor: 1-benzofuran-2-sulfonamide, Carbonic anhydrase 2, ZINC ION Authors: Snyder, P.W, Heroux, A, Whitesides, G.W. Deposit date: 2011-05-26 Release date: 2011-10-19 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Mechanism of the hydrophobic effect in the biomolecular recognition of arylsulfonamides by carbonic anhydrase. Proc.Natl.Acad.Sci.USA, 108, 2011
3S8X	Crystal structure of human carbonic anhydrase isozyme II with 4-{[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide Descriptor: 4-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}benzenesulfonamide, BICINE, Carbonic anhydrase 2, ... Authors: Grazulis, S, Manakova, E, Tamulaitiene, G. Deposit date: 2011-05-31 Release date: 2012-04-11 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Design of [(2-pyrimidinylthio)acetyl]benzenesulfonamides as inhibitors of human carbonic anhydrases. Eur.J.Med.Chem., 51, 2012
3SA7	Crystal structure of wild-type HIV-1 protease in complex with AF55 Descriptor: N~2~-acetyl-N-[(2S,3R)-4-{(1,3-benzothiazol-6-ylsulfonyl)[(2S)-2-methylbutyl]amino}-3-hydroxy-1-phenylbutan-2-yl]-L-leucinamide, PHOSPHATE ION, Protease Authors: Schiffer, C.A, Nalam, M.N.L. Deposit date: 2011-06-02 Release date: 2012-06-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Protease Inhibitors that protrude out from substrate envelope are more susceptible to developing drug resistance To be Published
3SAF	Crystal structure of the human RRP6 catalytic domain with D313N mutation in the active site Descriptor: Exosome component 10, MAGNESIUM ION, YTTRIUM (III) ION Authors: Januszyk, K, Liu, Q, Lima, C.D. Deposit date: 2011-06-02 Release date: 2011-07-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Activities of human RRP6 and structure of the human RRP6 catalytic domain. Rna, 17, 2011
3SA8	Crystal structure of wild-type HIV-1 protease in complex with KB83 Descriptor: 3-hydroxy-N-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]benzamide, ACETATE ION, PHOSPHATE ION, ... Authors: Schiffer, C.A, Nalam, M.N.L. Deposit date: 2011-06-02 Release date: 2012-06-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Protease Inhibitors that protrude out from substrate envelope are more susceptible to developing drug resistance To be Published
3SAG	Crystal structure of the human RRP6 catalytic domain with D313N mutation in the active site Descriptor: Exosome component 10, MAGNESIUM ION, YTTRIUM (III) ION Authors: Januszyk, K, Liu, Q, Lima, C.D. Deposit date: 2011-06-02 Release date: 2011-07-06 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Activities of human RRP6 and structure of the human RRP6 catalytic domain. Rna, 17, 2011
3SBX	Crystal structure of a putative uncharacterized protein from Mycobacterium marinum bound to adenosine 5'-monophosphate AMP Descriptor: ADENOSINE MONOPHOSPHATE, Putative uncharacterized protein Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2011-06-06 Release date: 2011-06-15 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015
3SB8	Cu-mediated Dimer of T4 Lysozyme D61H/K65H by Synthetic Symmetrization Descriptor: COPPER (II) ION, Lysozyme Authors: Soriaga, A.B, Laganowsky, A, Zhao, M, Sawaya, M.R, Cascio, D, Yeates, T.O. Deposit date: 2011-06-03 Release date: 2011-09-21 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.65 Å) Cite: An approach to crystallizing proteins by metal-mediated synthetic symmetrization. Protein Sci., 20, 2011
3SC0	Crystal Structure of MMACHC (1-238), a human B12 processing enzyme, complexed with MethylCobalamin Descriptor: CO-METHYLCOBALAMIN, Methylmalonic aciduria and homocystinuria type C protein Authors: Koutmos, M, Gherasim, C, Smith, J.L, Banerjee, R. Deposit date: 2011-06-06 Release date: 2011-06-22 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Structural basis of multifunctionality in a vitamin B12-processing enzyme. J.Biol.Chem., 286, 2011
3SD0	Identification of a Glycogen Synthase Kinase-3b Inhibitor that Attenuates Hyperactivity in CLOCK Mutant Mice Descriptor: 3-(5-fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-methoxy-1-benzofuran-3-yl)-1H-pyrrole-2,5-dione, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Glycogen synthase kinase-3 beta Authors: Mesecar, A.M, Walters, R.L. Deposit date: 2011-06-08 Release date: 2011-08-03 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Identification of a Glycogen Synthase Kinase-3b Inhibitor that Attenuates Hyperactivity in CLOCK Mutant Mice To be Published
3SDK	Structure of yeast 20S open-gate proteasome with Compound 34 Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, MAGNESIUM ION, N-[(2S)-3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-1-({(2S)-1-[(4-methylbenzyl)amino]-1-oxo-4-phenylbutan-2-yl}amino)-1-oxopropan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide, ... Authors: Sintchak, M.D. Deposit date: 2011-06-09 Release date: 2012-06-13 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Optimization of a series of dipeptides with a P3 threonine residue as non-covalent inhibitors of the chymotrypsin-like activity of the human 20S proteasome. Bioorg.Med.Chem.Lett., 20, 2010
3SD3	The structure of the tetrahydrofolate riboswitch containing a U25C mutation Descriptor: IRIDIUM HEXAMMINE ION, N-[4-({[(6S)-2-amino-5-formyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid, Tetrahydrofolate riboswitch Authors: Reyes, F.E, Trausch, J.J, Ceres, P, Batey, R.T. Deposit date: 2011-06-08 Release date: 2011-09-21 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.95 Å) Cite: The structure of a tetrahydrofolate-sensing riboswitch reveals two ligand binding sites in a single aptamer. Structure, 19, 2011
3SH2	Staphylococcus aureus Dihydrofolate Reductase complexed with NADPH and 6-ethyl-5-(3-(4-methoxybiphenyl-3-yl)prop-1-ynyl)pyrimidine-2,4-diamine (UCP120J) Descriptor: 6-ethyl-5-[3-(4-methoxybiphenyl-3-yl)prop-1-yn-1-yl]pyrimidine-2,4-diamine, Dihydrofolate reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Frey, K.M, Anderson, A.C. Deposit date: 2011-06-15 Release date: 2012-03-07 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.999 Å) Cite: Toward New Therapeutics for Skin and Soft Tissue Infections: Propargyl-Linked Antifolates Are Potent Inhibitors of MRSA and Streptococcus pyogenes. Plos One, 7, 2012
3SHY	Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors Descriptor: 6-ethyl-5-fluoro-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one, MAGNESIUM ION, ZINC ION, ... Authors: Chen, T.T, Chen, T, Xu, Y.C. Deposit date: 2011-06-17 Release date: 2011-08-24 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (2.647 Å) Cite: Utilization of Halogen Bond in Lead Optimization: A Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors. J.Med.Chem., 54, 2011
3SF0	Structure of Recombinant Haemophilus Influenzae e(P4) Acid Phosphatase mutant D64N complexed with 5'AMP Descriptor: ADENOSINE MONOPHOSPHATE, Lipoprotein E, MAGNESIUM ION Authors: Singh, H. Deposit date: 2011-06-12 Release date: 2011-09-28 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.35 Å) Cite: Structural basis of the inhibition of class C acid phosphatases by adenosine 5'-phosphorothioate. Febs J., 278, 2011
3SIX	Crystal structure of NodZ alpha-1,6-fucosyltransferase soaked with GDP-fucose Descriptor: CHLORIDE ION, GUANOSINE-5'-DIPHOSPHATE, Nodulation fucosyltransferase NodZ, ... Authors: Brzezinski, K, Dauter, Z, Jaskolski, M. Deposit date: 2011-06-20 Release date: 2012-02-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Structures of NodZ alpha-1,6-fucosyltransferase in complex with GDP and GDP-fucose Acta Crystallogr.,Sect.D, 68, 2012
3SGN	Bromoderivative-8 of amyloid-related segment of alphaB-crystallin residues 90-100 Descriptor: Alpha-crystallin B chain Authors: Laganowsky, A, Sawaya, M.R, Cascio, D, Eisenberg, D. Deposit date: 2011-06-15 Release date: 2012-03-21 Last modified: 2025-03-26 Method: X-RAY DIFFRACTION (2.807 Å) Cite: Atomic view of a toxic amyloid small oligomer. Science, 335, 2012

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