All Stories

  1. Interference of Sulphonate Buffering Agents with E. coli Hypoxanthine-Guanine Phosphoribosyltransferase Active Site Functioning: A Crystallographic and Enzymological Study
  2. Myelin Basic Protein Attenuates Furin-Mediated Bri2 Cleavage and Postpones Its Membrane Trafficking
  3. Designing an Efficient Biocatalyst for the Phosphoribosylation of Antiviral Pyrazine-2-carboxamide Derivatives
  4. Application of Protein Crystallography and Machine Learning Data for the Development of a Peptide Vaccine against African Swine Fever
  5. Application of the Crystal Structure of the SARS-CoV-2 Spike Protein for the Development of a Peptide Vaccine against Virus
  6. Preliminary X-ray Study of Crystals Obtained by Co-Crystallization of Hypoxanthine‒Guanine Phosphoribosyltransferase from Escherichia coli and Pyrazine-2-Carboxamide Derivatives
  7. Search for New Potential T-Cell and B-Cell Epitopes in the Spike Protein of SARS-CoV-2
  8. Search for Potential Epitopes in the Envelope Protein of the African Swine Fever Virus
  9. Study of the Precrystallization Solution of Lysozyme by Accelerated Molecular Dynamics Simulation
  10. How the Hinge Region Affects Interactions between the Catalytic and β-Propeller Domains in Oligopeptidase B
  11. Study of the Formation of Precursor Clusters in an Aqueous Solution of KH2PO4 by Small-Angle X-ray Scattering and Molecular Dynamics
  12. X-ray structure of recombinant house dust mite allergen Der p 3
  13. An Algorithm for the Development of a Recombinant Antiherpetic Subunit Vaccine Combining the Crystal Structure Analysis, AlphaFold2-Based Modeling, and Immunoinformatics
  14. Structural Bioinformatics Study of the Structural Basis of Substrate Specificity of Purine Nucleoside Phosphorylase from Thermus thermophilus
  15. Identification of the precursor cluster in thermolysin crystallization solution by molecular dynamics methods
  16. Preparation, Crystallization, and Preliminary X-ray Diffraction Analysis of Recombinant House Dust Mite Allergen Der p 3 from Dermatophagoides pteronyssinus
  17. Crystal Structure of Inhibitor-Bound Bacterial Oligopeptidase B in the Closed State: Similarity and Difference between Protozoan and Bacterial Enzymes
  18. Protein Crystallography: Achievements and Challenges
  19. Comparative Analysis of the Interfaces between Monomers in the Dimers of Bacterial Histone-Like HU Proteins by the MM-GBSA Method
  20. Modeling of the Interaction of Cytochrome c with Cardiolipin
  21. Modeling the Interaction of Human Lipoxygenase LOX 15 with Free Arachidonic Acid
  22. Study of Human Lipoxygenase by the Method of Molecular and Quantum Mechanics
  23. Unusual Temperature Behavior of Stability of Proteinase K Dimer Formed in Crystallization Solution Defined by Molecular Dynamics
  24. Comparative structural analysis of a histone-like protein from Spiroplasma melliferum in the crystalline state and in solution
  25. Rational Mutagenesis in the Lid Domain of Ribokinase from E. coli Results in an Order of Magnitude Increase in Activity towards D-arabinose
  26. Unusual Cytochrome c552 from Thioalkalivibrio paradoxus: Solution NMR Structure and Interaction with Thiocyanate Dehydrogenase
  27. Crystallization and Preliminary X-Ray Diffraction Analysis of Recombinant Phosphoribosylpyrophosphate Synthetase I from Thermus thermophilus HB27
  28. Modeling of the Interaction of Cytochrome c with the Lipid Bilayer
  29. The neuropeptide cycloprolylglycine can form a complex with AMPA receptors
  30. Immunoinformatic Design of a Multivalent Peptide Vaccine Against Mucormycosis: Targeting FTR1 Protein of Major Causative Fungi
  31. Study of the Binding Free Energy of Peptide Substrates in the Active Site of Oligopeptidase B from Serratia proteamaculans by the MM-GBSA Method
  32. The Role of Cations and Anions in the Formation of Crystallization Oligomers in Protein Solutions as Revealed by Combination of Small-Angle X-ray Scattering and Molecular Dynamics
  33. Elucidation of the Conformational Transition of Oligopeptidase B by an Integrative Approach Based on the Combination of X-ray, SAXS, and Essential Dynamics Sampling Simulation
  34. Modeling the molecular dynamics of cytochrome C in aqueous and water–methanol environment
  35. Early Stage of Structural Changes and Molecular Dynamics of Cytochrome C in an Aqueous Solution Caused by the Addition of Methanol
  36. Effect of V23Q and K24T Mutations on the Mobility of Atoms in L-Asparaginase from Wolinella succinigenes
  37. Identification of the Precursor Cluster in the Crystallization Solution of Proteinase K Protein by Molecular Dynamics Methods
  38. Computational designing of a novel subunit vaccine for human cytomegalovirus by employing the immunoinformatics framework
  39. The Role of Cations of the Precipitant in the Interaction of Protein Molecules in the Lysozyme Oligomers in Crystallization Solutions
  40. Erratum to: Effect of the Simulation Box Size and Precipitant Concentration on the Behavior of Tetragonal Lysozyme Dimer
  41. The Crystal Structure of Nα-p-tosyl-lysyl Chloromethylketone-Bound Oligopeptidase B from Serratia Proteamaculans Revealed a New Type of Inhibitor Binding
  42. Modeling of the Complex of the N-Methyl–D-Aspartate (NMDA) Receptor with Lipids of the Postsynaptic Membrane
  43. Modeling of the Lipid Bilayer Mimicking the Inner Mitochondrial Membrane
  44. Molecular Dynamics Study of Escherichia coli Thymidine Phosphorylase in a Complex with 3'-Azidothymidine Inhibitor and Phosphate
  45. Molecular Dynamics Study of the Viscosity Change in the Postsynaptic Membrane upon a Variation in Its Composition
  46. First Crystal Structure of Bacterial Oligopeptidase B in an Intermediate State: The Roles of the Hinge Region Modification and Spermine
  47. Comparison of Spatial Structures and Packaging of Phosphorybosil Pyrophosphate Synthetase 2 from Thermus thermophilus HB27 in Rhombohedral and Tetragonal Crystals
  48. Free Energy Change during the Formation of Crystalline Contact between Lysozyme Monomers under Different Physical and Chemical Conditions
  49. Study of the Interaction of Sorption and Catalytic Centers in Carboxypeptidase T by X-ray Analysis
  50. Effect of Disruption of the Interface between Monomers in a Dimer on the Structural and Dynamic Properties of the HU Protein from Spiroplasma Melliferum
  51. Molecular Dynamics of the Self-Organization of Dilinoleoyl Phosphatidylethanolamine Molecules
  52. Three-Dimensional Structure of Recombinant Thermophilic Ribokinase from Thermus speсies 2.9 in Complex with Adenosine Diphosphate
  53. Simulation of A Bilayer Imitating the Inner Mitochondrial Membrane Using Coarse-Grained Molecular Dynamics
  54. Effect of the Simulation Box Size and Precipitant Concentration on the Behavior of Tetragonal Lysozyme Dimer
  55. Preparation, Crystallization, and Preliminary X-Ray Diffraction Study of Mutant Carboxypeptidase T Bearing the Hydrophilized Primary Specificity Pocket
  56. Immunoinformatics analysis to design novel epitope based vaccine candidate targeting the glycoprotein and nucleoprotein of Lassa mammarenavirus (LASMV) using strains from Nigeria
  57. Structure of the microbial carboxypeptidase T complexed with the transition state analog N-sulfamoyl-l-lysine
  58. The comparative analysis of the properties and structures of purine nucleoside phosphorylases from thermophilic bacterium Thermus thermophilus HB27
  59. Crystallographic Study of Mutants and Complexes of Oligopeptidase B from Serratia proteamaculans
  60. Inhibitor Targeting the Interface between Monomers of HU Protein from Spiroplasma melliferum Disrupts Conformational Dynamics and DNA-Binding Properties of the Protein
  61. Preparation, Crystallization, and Preliminary X-Ray Diffraction Study of Mutant Carboxypeptidase T Bearing the Primary Specificity Pocket and the Active-Site Loop of Carboxypeptidase B
  62. Structure-based inhibitors targeting the alpha-helical domain of the Spiroplasma melliferum histone-like HU protein
  63. Features of Optical Activity in Inorganic and Organic Materials
  64. Molecular Dynamics Calculations of the Interaction Energy of Imidazole Glycerol Phosphate Dehydratase from Mycobacterium tuberculosis with Triazole Derivatives
  65. Three-Dimensional Structure of Branched-Chain Amino Acid Transaminase from Thermoproteus uzoniensis in Complex with L-Norvaline
  66. Precipitant ions influence on lysozyme oligomers stability investigated by molecular dynamics simulation at different temperatures
  67. Molecular Packing of a Mutant of L-Asparaginase from Wolinella succinigenes in Two Crystal Modifications
  68. Features of the Three Dimensional Structure of the Mutant Form of Wolinella succinogenes L-Asparaginase in Complexes with L-Aspartic and L-Glutamic Acids
  69. Screening of Conditions that Facilitate Crystallization of Oligopeptidase B from Serratia Proteamaculans by Differential Scanning Fluorimetry
  70. Crystal Packing of Phosphopantetheine Adenylyltransferase from Mycobacterium tuberculosis in Two Crystal Modifications
  71. The nature of the ligand’s side chain interacting with the S1'-subsite of metallocarboxypeptidase T (from Thermoactinomyces vulgaris) determines the geometry of the tetrahedral transition complex
  72. The binding of precipitant ions in the tetragonal crystals of hen egg white lysozyme
  73. Molecular dynamics complemented by site-directed mutagenesis reveals significant difference between the interdomain salt bridge networks stabilizing oligopeptidases B from bacteria and protozoa in their active conformations
  74. Crystallization and Preliminary X-ray Diffraction Study of a Mutant of L-Asparaginase from Wolinella succinogenes
  75. Molecular Dynamics Study of Binding of Substrates Bearing Two Positively Charged Residues to Oligopeptidase B from Serratia proteamaculans
  76. Three-Dimensional Structure of a Mutant of Carboxypeptidase T from Thermoactinomyces vulgaris Bearing an Implanted S1' Subsite of Pancreatic Carboxypeptidase B Complexed with a Product Analog
  77. Dodecamers derived from the crystal structure were found in the pre-crystallization solution of the transaminase from the thermophilic bacterium Thermobaculum terrenum by small-angle X-ray scattering
  78. Molecular Dynamics Study of Triazole Derivative Binding to the Active Site of Imidazole Glycerol Phosphate Dehydratase from Mycobacterium tuberculosis
  79. Virtual Screening Targeting Dimerization Signals of Two Mycoplasma HU Proteins Revealed Different Types of Inhibitors Interacting with Common Binding Determinants
  80. Functional characterization of PLP fold type IV transaminase with a mixed type of activity from Haliangium ochraceum
  81. Modeling of Phosphoribosylpyrophosphate Synthetase from Thermus Thermophilus in Complex with ATP and Ribose 5-Phosphate
  82. Molecular Dynamics Study of Thymidine Phosphorylase from E. coli in the Apo Form and in Complexes with Substrates
  83. Study of the Influence of a Precipitant Cation on the Formation of Oligomers in Crystallization Solutions of Lysozyme Protein
  84. Pre-crystallization phase formation of thermolysin hexamers in solution close to crystallization conditions
  85. Mobile Loop in the Active Site of Metallocarboxypeptidases as an Underestimated Determinant of Substrate Specificity
  86. An explanation for the narrow carbohydrate substrate specificity of adenine phosphoribosyltransferase from Thermus thermophilus from the model of the enzyme, substrate, and magnesium cation cofactor complex
  87. Study of the Behavior of Lysozyme Oligomers in Solutions by the Molecular Dynamics Method
  88. Crystal structure of mutant carboxypeptidase T from Thermoactinomyces vulgaris with an implanted S1′ subsite from pancreatic carboxypeptidase B
  89. Crystallization and Preliminary X-ray Diffraction Study of Purine Nucleoside Phosphorylase from the Thermophilic Bacterium Thermus thermophilus Strain HB27
  90. Three-Dimensional Structure of Recombinant Adenine Phosphoribosyltransferase from Thermophilic Bacterial Strain Thermus thermophilus HB27
  91. Crystal structure ofEscherichia colipurine nucleoside phosphorylase complexed with acyclovir
  92. Crystal structure ofEscherichia colipurine nucleoside phosphorylase in complex with 7-deazahypoxanthine
  93. Structural plasticity and thermal stability of the histone-like protein from Spiroplasma melliferum are due to phenylalanine insertions into the conservative scaffold
  94. Discovery of Selective Inhibitors of Imidazoleglycerol-Phosphate Dehydratase from Mycobacterium tuberculosis by Virtual Screening
  95. Crystal structures of carboxypeptidase T complexes with transition-state analogs
  96. Comparison of histone-like HU protein DNA-binding properties and HU/IHF protein sequence alignment
  97. Application of virtual screening and molecular dynamics for the analysis of selectivity of inhibitors of HU proteins targeted to the DNA-recognition site
  98. Activity modulation of the oligopeptidase B from Serratia proteamaculans by site-directed mutagenesis of amino acid residues surrounding catalytic triad histidine
  99. Crystallization and preliminary X-ray diffraction study of recombinant adenine phosphoribosyltransferase from the thermophilic bacterium Thermus thermophilus strain HB27
  100. Crystal structure of recombinant phosphoribosylpyrophosphate synthetase 2 fromThermus thermophilusHB27 complexed with ADP and sulfate ions
  101. Virtual screening of selective inhibitors of phosphopantetheine adenylyltransferase from Mycobacterium tuberculosis
  102. Structure of the carboxypeptidase B complex with N-sulfamoyl-L-phenylalanine – a transition state analog of non-specific substrate
  103. Three-dimensional structure of porcine pancreatic carboxypeptidase B with an acetate ion and two zinc atoms in the active site
  104. Crystallization and preliminary X-ray diffraction analysis of recombinant phosphoribosylpyrophosphate synthetase from the Thermophilic thermus thermophilus strain HB27
  105. Enhanced conformational flexibility of the histone-like (HU) protein from Mycoplasma gallisepticum
  106. Crystallization and preliminary X-ray diffraction study of recombinant ribokinase from Thermus Species 2.9
  107. Protein crystallization under microgravity conditions. Analysis of the results of Russian experiments performed on the International Space Station in 2005−2015
  108. Investigation of the Initial Crystallization Stage in Lysozyme Solutions by Small-Angle X-ray Scattering
  109. Three-dimensional structure of E. Coli purine nucleoside phosphorylase at 0.99 Å resolution
  110. In situ study of the state of lysozyme molecules at the very early stage of the crystallization process by small-angle X-ray scattering
  111. Three-dimensional structure of phosphoribosyl pyrophosphate synthetase from E. coli at 2.71 Å resolution
  112. Isolation, purification, crystallization, and preliminary X-ray diffraction study of the crystals of HU protein from M. gallisepticum
  113. Structure of the complex of carboxypeptidase B and N-sulfamoyl-L-arginine
  114. Crystallization and preliminary X-ray diffraction study of phosphoribosyl pyrophosphate synthetase from E. Coli
  115. Crystallization and preliminary X-ray diffraction study of phosphopantetheine adenylyltransferase from M. tuberculosis crystallizing in space group P32
  116. Structure of recombinant prolidase fromThermococcus sibiricusin space groupP21221
  117. Purification, crystallization, and preliminary X-ray diffraction study of purine nucleoside phosphorylase from E. coli
  118. Crystallization and preliminary X-ray diffraction study of porcine carboxypeptidase B
  119. Structural insights into the broad substrate specificity of carboxypeptidase T fromThermoactinomyces vulgaris
  120. 3′-Azidothymidine in the active site ofEscherichia colithymidine phosphorylase: the peculiarity of the binding on the basis of X-ray study
  121. Three-dimensional structure of thymidine phosphorylase from E. coli in complex with 3′-azido-2′-fluoro-2′,3′-dideoxyuridine
  122. Three-dimensional structure of carboxypeptidase T from Thermoactinomyces vulgaris in complex with N-BOC-L-leucine
  123. X-ray study of the conformational changes in the molecule of phosphopantetheine adenylyltransferase fromMycobacterium tuberculosisduring the catalyzed reaction
  124. Three-dimensional structure of phosphopantetheine adenylyltransferase from Mycobacterium tuberculosis in the apo form and in complexes with coenzyme A and dephosphocoenzyme A
  125. Crystal growth of phosphopantetheine adenylyltransferase, carboxypeptidase t, and thymidine phosphorylase on the international space station by the capillary counter-diffusion method
  126. Three-dimensional structure of recombinant carboxypeptidase T from Thermoactinomyces vulgaris without calcium ions
  127. Preparation of the Crystal Complex of Phosphopantetheine Adenylyltransferase from Mycobacterium tuberculosis with Coenzyme A and Investigation of Its Three-Dimensional Structure at 2.1-Å Resolution
  128. Recombinant formate dehydrogenase from Arabidopsis thaliana: Preparation, crystal growth in microgravity, and preliminary X-ray diffraction study
  129. Preparation, crystallization, and preliminary X-ray diffraction study of mutant carboxypeptidase T containing the primary specificity pocket of carboxypeptidase B
  130. X-ray investigation of gene-engineered human insulin crystallized from a solution containing polysialic acid
  131. Protein crystal growth on the Russian segment of the International Space Station
  132. Structure of the homodimer of uridine phosphorylase from Salmonella typhimurium in the native state at 1.9 Å resolution
  133. Isolation, crystallization and preliminary crystallographic analysis ofSalmonella typhimuriumuridine phosphorylase crystallized with 2,2′-anhydrouridine