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Large-Scale Crystallographic Fragment Screening Expedites Compound Optimization and Identifies Putative Protein-Protein Interaction Sites

The identification of starting points for compound development is one of the key steps in early-stage drug discovery. Information-rich techniques such as crystallographic fragment screening can potentially increase the efficiency of this step by providing the structural information of the binding mode of the ligands in addition to the mere binding information. Here, we present the crystallographic

Introduction: Stuckness and Sites of Confinement

Cs₃Cu₄In₂Cl₁₃ Nanocrystals : A Perovskite-Related Structure with Inorganic Clusters at A Sites

An effort to synthesize the Cu(I) variant of a lead-free double perovskite isostructural with Cs2AgInCl6 resulted in the formation of Cs3Cu4In2Cl13 nanocrystals with an unusual structure, as revealed by single-nanocrystal three-dimensional electron diffraction. These nanocrystals adopt a A2BX6 structure (K2PtCl6 type, termed vacancy ordered perovskite) with tetrahedrally coordinated Cu(I) ions. In

Site-directed mutagenesis of cysteine residues alters oxidative stability of fetal hemoglobin

Scapular osseous free flap in head and neck reconstruction : An assessment of the postoperative function of the donor site

Source contributions in precipitation chemistry and analysis of atmospheric nitrogen deposition in a Sahelian dry savanna site in West Africa

Experimental data on precipitation chemistry were collected at a semi-arid savanna in Senegal (Dahra) in 2013, 2014 and 2017. The chemical composition of precipitation was analyzed for inorganic and organic ions, using ionic chromatography. The pH values of precipitation range from 4.50 to 8.50 with 89% of the samples having basic pH. The composition of precipitation was controlled by four source

For everyday use and special occasions : a multi-analytical study of pottery from two early neolithic funnel beaker (TRB) sites on the island of Öland, SE Sweden

Intracerebral grafting of neuronal cell suspensions. II. Survival and growth of nigral cells implanted in different brain sites

Quantifying archaeo-organic degradation – A multiproxy approach to understand the accelerated deterioration of the ancient organic cultural heritage at the Swedish Mesolithic site Ageröd

Modeling the forest phosphorus nutrition in a southwestern Swedish forest site

A Nested Case–Control Study on the Risk of Surgical Site Infection After Thyroid Surgery

Chemical Understanding of the Limited Site-Specificity in Molecular Inner-Shell Photofragmentation

Hydride binding to the active site of [FeFe]-hydrogenase

Effect of exchange of the cysteine molybdenum ligand with selenocysteine on the structure and function of the active site in human sulfite oxidase

Identification of an endothelial cell binding site on kininogen domain D3

Mapping the cell binding site on high molecular weight kininogen domain 5

Heterogeneity of benzodiazepine receptor interactions with γ-aminobutyric acid and barbiturate receptor sites

Perturbation of benzodiazepine receptor binding by pyrazolopyridines involves picrotoxinin/barbiturate receptor sites

Dihydropicrotoxinin binding sites in mammalian brain : Interaction with convulsant and depressant benzodiazepines

The specific binding of [3H]α-dihydropicrotoxinin to rat brain membranes was inhibited competitively and potently (IC50 ≅ 100 nM) by a convulsant benzodiazepine drug, RO5-3663. This compound did not inhibit high affinity flunitrazepam binding to the same tissue under similar conditions, and its reported pharmacological activity as an antagonist of GABAergic synaptic transmission, which resembles t

Barbiturate receptor sites are coupled to benzodiazepine receptors