[HTML][HTML] Comparative structural and evolutionary analyses predict functional sites in the artemisinin resistance malaria protein K13

R Coppée, DC Jeffares, MA Miteva, A Sabbagh… - Scientific reports, 2019 - nature.com
Numerous mutations in the Plasmodium falciparum Kelch13 (K13) protein confer resistance
to artemisinin derivatives, the current front-line antimalarial drugs. K13 is an essential …

[HTML][HTML] SARS-CoV-2 mutations in Brazil: from genomics to putative clinical conditions

LFSM Timmers, JV Peixoto, RG Ducati, JFR Bachega… - Scientific reports, 2021 - nature.com
Due to the high rate of transmissibility, Brazil became the new COVID-19 outbreak epicenter
and, since then, is being monitored to understand how SARS-CoV-2 mutates and spreads …

Dissecting protein domain variability in the core RNA interference machinery of five insect orders

FBM Arraes, D Martins-de-Sa, DD Noriega Vasquez… - RNA biology, 2021 - Taylor & Francis
ABSTRACT RNA interference (RNAi)-mediated gene silencing can be used to control
specific insect pest populations. Unfortunately, the variable efficiency in the knockdown …

[HTML][HTML] Phylogenomic analyses and distribution of terpene synthases among Streptomyces

L Martín-Sánchez, KS Singh, M Avalos… - Beilstein journal of …, 2019 - beilstein-journals.org
Terpene synthases are widely distributed among microorganisms and have been mainly
studied in members of the genus Streptomyces. However, little is known about the …

Evorator: prediction of residue-level evolutionary rates from protein structures using machine learning

N Nagar, NB Tal, T Pupko - Journal of Molecular Biology, 2022 - Elsevier
Measuring evolutionary rates at the residue level is indispensable for gaining structural and
functional insights into proteins. State-of-the-art tools for estimating rates take as input a …

EvoRator2: predicting site-specific amino acid substitutions based on protein structural information using deep learning

N Nagar, J Tubiana, G Loewenthal, HJ Wolfson… - Journal of Molecular …, 2023 - Elsevier
Multiple sequence alignments (MSAs) are the workhorse of molecular evolution and
structural biology research. From MSAs, the amino acids that are tolerated at each site …

[HTML][HTML] Relative evolutionary rate inference in HyPhy with LEISR

SJ Spielman, SLK Pond - PeerJ, 2018 - peerj.com
We introduce LEISR (Likehood Estimation of Individual Site Rates, pronounced “laser”), a
tool to infer relative evolutionary rates from protein and nucleotide data, implemented in …

Improved prediction of site‐rates from structure with averaging across homologs

C Norn, F Oliveira, I André - Protein Science, 2024 - Wiley Online Library
Variation in mutation rates at sites in proteins can largely be understood by the constraint
that proteins must fold into stable structures. Models that calculate site‐specific rates based …

Relative evolutionary rates in proteins are largely insensitive to the substitution model

SJ Spielman… - Molecular Biology and …, 2018 - academic.oup.com
The relative evolutionary rates at individual sites in proteins are informative measures of
conservation or adaptation. Often used as evolutionarily aware conservation scores, relative …

Evolutionary and structural constraints influencing apolipoprotein A‐I amyloid behavior

RA Gisonno, T Masson, NA Ramella… - Proteins: Structure …, 2022 - Wiley Online Library
Abstract Apolipoprotein A‐I (apoA‐I) has a key function in the reverse cholesterol transport.
However, aggregation of apoA‐I single point mutants can lead to hereditary amyloid …