Binding and orientation of tricyclic antidepressants within the central substrate site of the human serotonin transporter. - Wikidata - awgldk - TriplyDB

Binding and orientation of tricyclic antidepressants within the central substrate site of the human serotonin transporter.

Binding and orientation of tricyclic antidepressants within the central substrate site of the human serotonin transporter.

http://www.wikidata.org/entity/Q33707171

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Monoamine transporters: insights from molecular dynamics simulations Insights to ligand binding to the monoamine transporters-from homology modeling to LeuBAT and dDAT Designing modulators of monoamine transporters using virtual screening techniques A conserved leucine occupies the empty substrate site of LeuT in the Na(+)-free return state.Structures of LeuT in bicelles define conformation and substrate binding in a membrane-like context Structural basis for action by diverse antidepressants on biogenic amine transporters Ligand induced conformational changes of the human serotonin transporter revealed by molecular dynamics simulations Mapping Cholesterol Interaction Sites on Serotonin Transporter through Coarse-Grained Molecular Dynamics Exploring the Inhibitory Mechanism of Approved Selective Norepinephrine Reuptake Inhibitors and Reboxetine Enantiomers by Molecular Dynamics Study A conserved salt bridge between transmembrane segments 1 and 10 constitutes an extracellular gate in the dopamine transporter Unbiased simulations reveal the inward-facing conformation of the human serotonin transporter and Na(+) ion release.Structure-activity relationships for a novel series of citalopram (1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile) analogues at monoamine transporters Discovery of novel-scaffold monoamine transporter ligands via in silico screening with the S1 pocket of the serotonin transporter Molecular determinants for selective recognition of antidepressants in the human serotonin and norepinephrine transporters.Properties of an inward-facing state of LeuT: conformational stability and substrate release.Identification of a novel selective serotonin reuptake inhibitor by coupling monoamine transporter-based virtual screening and rational molecular hybridization Probing binding pocket of serotonin transporter by single molecular force spectroscopy on living cells.Azidobupramine, an Antidepressant-Derived Bifunctional Neurotransmitter Transporter Ligand Allowing Covalent Labeling and Attachment of Fluorophores.Molecular mechanism of serotonin transporter inhibition elucidated by a new flexible docking protocol.Binding of the amphetamine-like 1-phenyl-piperazine to monoamine transporters.The solute carrier 6 family of transporters Steric hindrance mutagenesis in the conserved extracellular vestibule impedes allosteric binding of antidepressants to the serotonin transporter Mechanism of Paroxetine (Paxil) Inhibition of the Serotonin Transporter.Genetically encoded photocrosslinkers locate the high-affinity binding site of antidepressant drugs in the human serotonin transporter.The binding sites for benztropines and dopamine in the dopamine transporter overlap.Nanopharmacological Force Sensing to Reveal Allosteric Coupling in Transporter Binding Sites Design and synthesis of 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile (citalopram) analogues as novel probes for the serotonin transporter S1 and S2 binding sites.Identification of novel serotonin transporter compounds by virtual screening.Binding-induced fluorescence of serotonin transporter ligands: A spectroscopic and structural study of 4-(4-(dimethylamino)phenyl)-1-methylpyridinium (APP(+)) and APP(+) analogues.Substrate and drug binding sites in LeuT.Vesicular and plasma membrane transporters for neurotransmitters.Computational methods for the discovery of mood disorder therapies.Structure-activity relationship studies of citalopram derivatives: examining substituents conferring selectivity for the allosteric site in the 5-HT transporter Comparative modeling of the human monoamine transporters: similarities in substrate binding.(S)- and (R)-fluoxetine as native markers in mass spectrometry (MS) binding assays addressing the serotonin transporter.Binding site residues control inhibitor selectivity in the human norepinephrine transporter but not in the human dopamine transporter Importance of the Extracellular Loop 4 in the Human Serotonin Transporter for Inhibitor Binding and Substrate Translocation.Substrate binding and translocation of the serotonin transporter studied by docking and molecular dynamics simulations.Interaction of antidepressants with the serotonin and norepinephrine transporters: mutational studies of the S1 substrate binding pocket.A dualistic conformational response to substrate binding in the human serotonin transporter reveals a high affinity state for serotonin.

P2860

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P2860

Binding and orientation of tricyclic antidepressants within the central substrate site of the human serotonin transporter.

http://www.wikidata.org/entity/Q33707171

description

2009 nî lūn-bûn

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2009 թուականի Նոյեմբերին հրատարակուած գիտական յօդուած

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2009 թվականի նոյեմբերին հրատարակված գիտական հոդված

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2009年の論文

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2009年論文

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2009年論文

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2009年論文

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2009年論文

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2009年論文

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2009年论文

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name

Binding and orientation of tri ...... e human serotonin transporter.

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Binding and orientation of tri ...... e human serotonin transporter.

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type

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Binding and orientation of tri ...... e human serotonin transporter.

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Binding and orientation of tri ...... e human serotonin transporter.

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Binding and orientation of tri ...... e human serotonin transporter.

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Binding and orientation of tri ...... e human serotonin transporter.

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JBC.M109.045401

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Journal of Biological Chemistry

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Binding and orientation of tri ...... he human serotonin transporter

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Heidi Koldsø

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Henrik Helligsø Jensen

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Kasper Severinsen

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Leyla Celik

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Marie Jensen

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Mikael Bols

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Ove Wiborg

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Tine Meyer

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P2860

Plasma membrane monoamine transporters: structure, regulation and function

LeuT-desipramine structure reveals how antidepressants block neurotransmitter reuptake

The binding sites for cocaine and dopamine in the dopamine transporter overlap

Structure-activity relations for the inhibition of 5-hydroxytryptamine uptake by tricyclic antidepressants into synaptosomes from serotoninergic neurones in rat brain homogenates

Antidepressant binding site in a bacterial homologue of neurotransmitter transporters

A competitive inhibitor traps LeuT in an open-to-out conformation.

Relationship between the inhibition constant (K1) and the concentration of inhibitor which causes 50 per cent inhibition (I50) of an enzymatic reaction

Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy

Crystal structure of a bacterial homologue of Na+/Cl--dependent neurotransmitter transporters

Extra precision glide: docking and scoring incorporating a model of hydrophobic enclosure for protein-ligand complexes

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8363-8374

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scholarly article

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10.1074/JBC.M109.045401

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11

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285

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Steffen Sinning

Birgit Schiøtt

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2009-11-30T00:00:00Z

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40041819

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19948720

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