Search Results - "GHOSH, Shubhra"
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Reprogramming of glucose metabolism via PFKFB4 is critical in FGF16-driven invasion of breast cancer cells
Published in Bioscience reports (01-08-2023)“…Fibroblast growth factors (FGFs) are expressed in both developing and adult tissues and play important roles in embryogenesis, tissue homeostasis,…”
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2
In silico analyses of Wnt1 nsSNPs reveal structurally destabilizing variants, altered interactions with Frizzled receptors and its deregulation in tumorigenesis
Published in Scientific reports (02-09-2022)“…Wnt1 is the first mammalian Wnt gene, which is discovered as proto-oncogene and in human the gene is located on the chromosome 12q13. Mutations in Wnt1 are…”
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3
Dynamic and Static Water Molecules Complement the TN16 Conformational Heterogeneity inside the Tubulin Cavity
Published in Biochemistry (Easton) (19-01-2016)“…TN16 is one of the most promising inhibitors of α, β dimer of tubulin that occupies the cavity in the β-subunit located at the dimeric interface, known as the…”
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4
HKT1;5 Transporter Gene Expression and Association of Amino Acid Substitutions With Salt Tolerance Across Rice Genotypes
Published in Frontiers in plant science (04-11-2019)“…Plants need to maintain a low Na + /K + ratio for their survival and growth when there is high sodium concentration in soil. Under these circumstances, the…”
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An insight into SARS-CoV-2 structure, pathogenesis, target hunting for drug development and vaccine initiatives
Published in RSC medicinal chemistry (22-06-2022)“…SARS-CoV-2, the virus responsible for the COVID-19 pandemic, has been confirmed to be a new coronavirus having 79% and 50% similarity with SARS-CoV and…”
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6
An evolutionary analysis identifies a conserved pentapeptide stretch containing the two essential lysine residues for rice L-myo-inositol 1-phosphate synthase catalytic activity
Published in PloS one (26-09-2017)“…A molecular evolutionary analysis of a well conserved protein helps to determine the essential amino acids in the core catalytic region. Based on the chemical…”
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Adaptive Workflows of Machine Learning Illuminate the Sequential Operation Mechanism of the TAK1′s Allosteric Network
Published in Biochemistry (Easton) (14-05-2024)“…Allostery is a fundamental mechanism driving biomolecular processes that holds significant therapeutic concern. Our study rigorously investigates how two…”
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The susceptibility of disulfide bonds towards radiation damage may be explained by S⋯O interactions
Published in IUCrJ (01-09-2020)“…Radiation-induced damage to protein crystals during X-ray diffraction data collection is a major impediment to obtaining accurate structural information on…”
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9
Cholesterol Modulates Membrane Properties and the Interaction of gp41 Fusion Peptide To Promote Membrane Fusion
Published in The journal of physical chemistry. B (22-08-2019)“…An envelope glycoprotein, gp41, is crucial for the entry of human immunodeficiency virus (HIV) into the host cell. The 20–23 N-terminal amino acid sequence of…”
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10
Shifting Polar Residues Across Primary Sequence Frames of Transmembrane Domains Calibrates Membrane Permeation Thermodynamics
Published in Biochemistry (Easton) (17-11-2020)“…Permeation of the mitochondrial outer membrane (MOM) using the transmembrane domains (TMDs) is the key step of the Bcl-2 family of proteins to control…”
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Conformational States of E7010 Is Complemented by Microclusters of Water Inside the α,β-Tubulin Core
Published in Journal of chemical information and modeling (28-05-2019)“…The α,β-tubulin is the building block of microtubules, which is associated with and dissociated from the microtubular architecture complying with the dynamic…”
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Allosteric Boost by TAB1 on the TAK1 Kinase Favorably Sculpts the Thermodynamic Landscape of Activation
Published in Journal of chemical information and modeling (09-01-2023)“…The intricate mechanisms of allosteric regulation in kinases are of general interest to the scientific community for potential therapeutic implications…”
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Remote communication between unstructured and structured regions of Bcl-2 tunes its ligand binding capacity: Mechanistic insights
Published in Computational biology and chemistry (01-10-2022)“…Bcl-2, the prototypic, anti-apoptotic member of Bcl-2 family possesses a long Intrinsically Disordered Region (IDR) of more than sixty amino acid residues. In…”
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The long unstructured region of Bcl‐xl modulates its structural dynamics
Published in Proteins, structure, function, and bioinformatics (01-08-2017)“…ABSTRACT Bcl‐xl protein has a long unstructured loop attached to its structured region which joins two helices. The necessity to have this unstructured segment…”
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New insight to structure-function relationship of GalNAc mediated primary interaction between insecticidal Cry1Ac toxin and HaALP receptor of Helicoverpa armigera
Published in PloS one (24-10-2013)“…Over the last few decades Cry1Ac toxin has been widely used in controlling the insect attack due to its high specificity towards target insects. The…”
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The susceptibility of disulfide bonds towards radiation damage may be explained by S...O interactions
Published in IUCrJ (01-09-2020)“…Radiation-induced damage to protein crystals during X-ray diffraction data collection is a major impediment to obtaining accurate structural information on…”
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17
Dynamics of Bcl-xL in water and membrane: molecular simulations
Published in PloS one (08-10-2013)“…The Bcl2 family of proteins is capable of switching the apoptotic machinery by directly controlling the release of apoptotic factors from the mitochondrial…”
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Ligand Binding Swaps between Soft Internal Modes of α,β-Tubulin and Alters Its Accessible Conformational Space
Published in The journal of physical chemistry. B (12-01-2017)“…The dynamic instability of the microtubule originates from the conformational switching of its building block, that is, the α, β-tubulin dimer. Ligands…”
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BIM Binding Remotely Regulates BAX Activation: Insights from the Free Energy Landscapes
Published in Journal of chemical information and modeling (26-02-2018)“…Activation of the pro-apoptotic BAX protein, a BCL-2 family member, is known to trigger apoptosis by forming pores in the mitochondrial outer membrane (MOM)…”
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Dissecting the thermodynamic contributions of the charged residues in the membrane anchoring of Bcl-xl C-terminal domain
Published in Chemistry and physics of lipids (01-01-2019)“…•C-terminal double mutation (R232A and K233A) impedes Bcl-xl C-tail insertion.•Only one C-terminal polar residue (R232 or K233) is able to drive the…”
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