Using PyMOL as a platform for computational drug design

S Yuan, HCS Chan, Z Hu - Wiley Interdisciplinary Reviews …, 2017 - Wiley Online Library
PyMOL, a cross‐platform molecular graphics tool, has been widely used for three‐
dimensional (3D) visualization of proteins, nucleic acids, small molecules, electron …

[HTML][HTML] Multilevel proteomics reveals host perturbations by SARS-CoV-2 and SARS-CoV

A Stukalov, V Girault, V Grass, O Karayel, V Bergant… - Nature, 2021 - nature.com
The emergence and global spread of SARS-CoV-2 has resulted in the urgent need for an in-
depth understanding of molecular functions of viral proteins and their interactions with the …

[PDF][PDF] Posttranslational modifications mediate the structural diversity of tauopathy strains

T Arakhamia, CE Lee, Y Carlomagno, M Kumar… - Cell, 2020 - cell.com
Tau aggregation into insoluble filaments is the defining pathological hallmark of tauopathies.
However, it is not known what controls the formation and templated seeding of strain-specific …

[HTML][HTML] Using phosphoproteomics data to understand cellular signaling: a comprehensive guide to bioinformatics resources

SR Savage, B Zhang - Clinical Proteomics, 2020 - Springer
Mass spectrometry-based phosphoproteomics is becoming an essential methodology for the
study of global cellular signaling. Numerous bioinformatics resources are available to …

[HTML][HTML] EZH2 engages TGFβ signaling to promote breast cancer bone metastasis via integrin β1-FAK activation

L Zhang, J Qu, Y Qi, Y Duan, YW Huang, Z Zhou… - Nature …, 2022 - nature.com
Abstract Bone metastases occur in 50–70% of patients with late-stage breast cancers and
effective therapies are needed. The expression of enhancer of zeste homolog 2 (EZH2) is …

[HTML][HTML] Conformational interconversion of MLKL and disengagement from RIPK3 precede cell death by necroptosis

SE Garnish, Y Meng, A Koide, JJ Sandow… - Nature …, 2021 - nature.com
Phosphorylation of the MLKL pseudokinase by the RIPK3 kinase leads to MLKL
oligomerization, translocation to, and permeabilization of, the plasma membrane to induce …

Structural insights into the recognition of phosphorylated FUNDC1 by LC3B in mitophagy

M Lv, C Wang, F Li, J Peng, B Wen, Q Gong, Y Shi… - Protein & …, 2017 - academic.oup.com
Mitophagy is an essential intracellular process that eliminates dysfunctional mitochondria
and maintains cellular homeostasis. Mitophagy is regulated by the post-translational …

[HTML][HTML] Distinct pseudokinase domain conformations underlie divergent activation mechanisms among vertebrate MLKL orthologues

KA Davies, C Fitzgibbon, SN Young… - Nature …, 2020 - nature.com
The MLKL pseudokinase is the terminal effector in the necroptosis cell death pathway.
Phosphorylation by its upstream regulator, RIPK3, triggers MLKL's conversion from a …

Oxygen-dependent changes in binding partners and post-translational modifications regulate the abundance and activity of HIF-1α/2α

LA Daly, PJ Brownridge, M Batie, S Rocha, V Sée… - Science …, 2021 - science.org
Cellular adaptation to low-oxygen environments is mediated in part by the hypoxia-inducible
factors (HIFs). Like other transcription factors, the stability and transcriptional activity of HIFs …

[HTML][HTML] How multisite phosphorylation impacts the conformations of intrinsically disordered proteins

F Jin, F Gräter - PLoS computational biology, 2021 - journals.plos.org
Phosphorylation of intrinsically disordered proteins (IDPs) can produce changes in structural
and dynamical properties and thereby mediate critical biological functions. How …