Statistical potentials for improved structurally constrained evolutionary models.

Abstract:

:Assessing the influence of three-dimensional protein structure on sequence evolution is a difficult task, mainly because of the assumption of independence between sites required by probabilistic phylogenetic methods. Recently, models that include an explicit treatment of protein structure and site interdependencies have been developed: a statistical potential (an energy-like scoring system for sequence-structure compatibility) is used to evaluate the probability of fixation of a given mutation, assuming a coarse-grained protein structure that is constant through evolution. Yet, due to the novelty of these models and the small degree of overlap between the fields of structural and evolutionary biology, only simple representations of protein structure have been used so far. In this work, we present new forms of statistical potentials using a probabilistic framework recently developed for evolutionary studies. Terms related to pairwise distance interactions, torsion angles, solvent accessibility, and flexibility of the residues are included in the potentials, so as to study the effects of the main factors known to influence protein structure. The new potentials, with a more detailed representation of the protein structure, yield a better fit than the previously used scoring functions, with pairwise interactions contributing to more than half of this improvement. In a phylogenetic context, however, the structurally constrained models are still outperformed by some of the available site-independent models in terms of fit, possibly indicating that alternatives to coarse-grained statistical potentials should be explored in order to better model structural constraints.

journal_name

Mol Biol Evol

authors

Kleinman CL,Rodrigue N,Lartillot N,Philippe H

doi

10.1093/molbev/msq047

subject

Has Abstract

pub_date

2010-07-01 00:00:00

pages

1546-60

issue

7

eissn

0737-4038

issn

1537-1719

pii

msq047

journal_volume

27

pub_type

杂志文章
  • CCA Addition gone wild: Unusual Occurrence and Phylogeny of four different tRNA Nucleotidyltransferases in Acanthamoeba castellanii.

    abstract::tRNAs are important players in the protein synthesis machinery, where they act as adapter molecules for translating the mRNA codons into the corresponding amino acid sequence. In a series of highly conserved maturation steps, the primary transcripts are converted into mature tRNAs. In the amoebozoan Acanthamoeba caste...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msaa270

    authors: Erber L,Betat H,Mörl M

    更新日期:2020-10-23 00:00:00

  • Lactate dehydrogenase-B cDNA from the teleost Fundulus heteroclitus: evolutionary implications.

    abstract::A cDNA that encodes the heart-type lactate dehydrogenase (LDH-B) from the teleost fish Fundulus heteroclitus was cloned and sequenced. The protein encoded by the cDNA was analyzed in relation to 13 LDH proteins from a variety of taxa. One of the deductions from this analysis is that LDH-B proteins have residues in the...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a040559

    authors: Crawford DL,Constantino HR,Powers DA

    更新日期:1989-07-01 00:00:00

  • Evolutionary origins of human herpes simplex viruses 1 and 2.

    abstract::Herpesviruses have been infecting and codiverging with their vertebrate hosts for hundreds of millions of years. The primate simplex viruses exemplify this pattern of virus-host codivergence, at a minimum, as far back as the most recent common ancestor of New World monkeys, Old World monkeys, and apes. Humans are the ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msu185

    authors: Wertheim JO,Smith MD,Smith DM,Scheffler K,Kosakovsky Pond SL

    更新日期:2014-09-01 00:00:00

  • Bayesian phylogenetic model selection using reversible jump Markov chain Monte Carlo.

    abstract::A common problem in molecular phylogenetics is choosing a model of DNA substitution that does a good job of explaining the DNA sequence alignment without introducing superfluous parameters. A number of methods have been used to choose among a small set of candidate substitution models, such as the likelihood ratio tes...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msh123

    authors: Huelsenbeck JP,Larget B,Alfaro ME

    更新日期:2004-06-01 00:00:00

  • SSU rRNA-based phylogenetic position of the genera Amoeba and Chaos (Lobosea, Gymnamoebia): the origin of gymnamoebae revisited.

    abstract::Naked lobose amoebae (gymnamoebae) are among the most abundant group of protists present in all aquatic and terrestrial biotopes. Yet, because of lack of informative morphological characters, the origin and evolutionary history of gymnamoebae are poorly known. The first molecular studies revealed multiple origins for ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a003777

    authors: Bolivar I,Fahrni JF,Smirnov A,Pawlowski J

    更新日期:2001-12-01 00:00:00

  • Vertebrate serpins: construction of a conflict-free phylogeny by combining exon-intron and diagnostic site analyses.

    abstract::A combination of three independent biological features, genomic organization, diagnostic amino acid sites, and rare indels, was used to elucidate the phylogeny of the vertebrate serpin (serine protease inhibitor) superfamily. A strong correlation between serpin gene families displaying (1) a conserved exon-intron patt...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a003838

    authors: Ragg H,Lokot T,Kamp PB,Atchley WR,Dress A

    更新日期:2001-04-01 00:00:00

  • Kinesin-related genes from diplomonad, sponge, amphioxus, and cyclostomes: divergence pattern of kinesin family and evolution of giardial membrane-bounded organella.

    abstract::To understand the question of whether divergence of eukaryotic genes by gene duplications and domain shufflings proceeded gradually or intermittently during evolution, we have cloned and sequenced Giardia lamblia cDNAs encoding kinesins and kinesin-related proteins and have obtained 13 kinesin-related cDNAs, some of w...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a004215

    authors: Iwabe N,Miyata T

    更新日期:2002-09-01 00:00:00

  • Evolution of the multifunctional protein tyrosine phosphatase family.

    abstract::The protein tyrosine phosphatase (PTP) family plays a central role in signal transduction pathways by controlling the phosphorylation state of serine, threonine, and tyrosine residues. PTPs can be divided into dual specificity phosphatases and the classical PTPs, which can comprise of one or two phosphatase domains. W...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msh055

    authors: Pils B,Schultz J

    更新日期:2004-04-01 00:00:00

  • Satellite DNA of the red flour beetle Tribolium castaneum--comparative study of satellites from the genus Tribolium.

    abstract::A highly abundant satellite DNA comprising 17% of the Tribolium castaneum (Insecta, Coleoptera) genome was cloned and sequenced. The satellite monomer is 360 bp long, has a high A+T content of 73%, and lacks significant internal substructures. The sequence variability is 3.6%, essentially due to random distribution of...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a025668

    authors: Ugarković D,Podnar M,Plohl M

    更新日期:1996-10-01 00:00:00

  • Colocality to Cofunctionality: Eukaryotic Gene Neighborhoods as a Resource for Function Discovery.

    abstract::Diverging from the classic paradigm of random gene order in eukaryotes, gene proximity can be leveraged to systematically identify functionally related gene neighborhoods in eukaryotes, utilizing techniques pioneered in bacteria. Current methods of identifying gene neighborhoods typically rely on sequence similarity t...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msaa221

    authors: Foflonker F,Blaby-Haas CE

    更新日期:2021-01-23 00:00:00

  • Evolution of primate ABO blood group genes and their homologous genes.

    abstract::There are three common alleles (A, B, and O) at the human ABO blood group locus. We compared nucleotide sequences of these alleles, and relatively large numbers of nucleotide differences were found among them. These differences correspond to the divergence time of at least a few million years, which is unusually large...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a025776

    authors: Saitou N,Yamamoto F

    更新日期:1997-04-01 00:00:00

  • An improved likelihood ratio test for detecting site-specific functional divergence among clades of protein-coding genes.

    abstract::Maximum likelihood codon substitution models have proven useful for studying when and how protein function evolves, but they have recently been criticized on a number of fronts. The strengths and weaknesses of such methods must therefore be identified and improved upon. Here, using simulations, we show that the Clade ...

    journal_title:Molecular biology and evolution

    pub_type: 信件

    doi:10.1093/molbev/msr311

    authors: Weadick CJ,Chang BS

    更新日期:2012-05-01 00:00:00

  • Evolution and phylogenetic utility of alignment gaps within intron sequences of three nuclear genes in bumble bees (Bombus).

    abstract::To test whether gaps resulting from sequence alignment contain phylogenetic signal concordant with those of base substitutions, we analyzed the occurrence of indel mutations upon a well-resolved, substitution-based tree for three nuclear genes in bumble bees (Bombus, Apidae: Bombini). The regions analyzed were exon an...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msg007

    authors: Kawakita A,Sota T,Ascher JS,Ito M,Tanaka H,Kato M

    更新日期:2003-01-01 00:00:00

  • Numerous transposed sequences of mitochondrial cytochrome oxidase I-II in aphids of the genus Sitobion (Hemiptera: Aphididae).

    abstract::Polymerase chain reaction (PCR) products corresponding to 803 bp of the cytochrome oxidase subunits I and II region of mitochondrial DNA (mtDNA COI-II) were deduced to consist of multiple haplotypes in three Sitobion species. We investigated the molecular basis of these observations. PCR products were cloned, and six ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a025612

    authors: Sunnucks P,Hales DF

    更新日期:1996-03-01 00:00:00

  • Human SNPs reveal no evidence of frequent positive selection.

    abstract::We compared the single-nucleotide polymorphisms (SNPs) in humans in 182 housekeeping and 148 tissue-specific genes. SNPs were divided into rare and common polymorphisms based on their frequencies. We found that housekeeping genes tend to be less polymorphic than tissue-specific genes for both rare and common SNPs. Usi...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msi240

    authors: Zhang L,Li WH

    更新日期:2005-12-01 00:00:00

  • Inferring population mutation rate and sequencing error rate using the SNP frequency spectrum in a sample of DNA sequences.

    abstract::One challenge of analyzing samples of DNA sequences is to account for the nonnegligible polymorphisms produced by error when the sequencing error rate is high or the sample size is large. Specifically, those artificial sequence variations will bias the observed single nucleotide polymorphism (SNP) frequency spectrum, ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msp059

    authors: Liu X,Maxwell TJ,Boerwinkle E,Fu YX

    更新日期:2009-07-01 00:00:00

  • Evolution of the T1 retroposon family in the Anopheles gambiae complex.

    abstract::The T1 family of retrotransposable elements is interspersed and moderately repeated in five member species of the Anopheles gambiae sibling-species complex and has diverged little since the radiation of the complex. T1 includes two closely related but independent subfamilies, defined by the presence or absence of link...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a040599

    authors: Besansky NJ

    更新日期:1990-05-01 00:00:00

  • Evolution of the Genome 3D Organization: Comparison of Fused and Segregated Globin Gene Clusters.

    abstract::The genomes are folded in a complex three-dimensional (3D) structure. Some features of this organization are common for all eukaryotes, but little is known about its evolution. Here, we have studied the 3D organization and regulation of zebrafish globin gene domain and compared its organization and regulation with tho...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msx100

    authors: Kovina AP,Petrova NV,Gushchanskaya ES,Dolgushin KV,Gerasimov ES,Galitsyna AA,Penin AA,Flyamer IM,Ioudinkova ES,Gavrilov AA,Vassetzky YS,Ulianov SV,Iarovaia OV,Razin SV

    更新日期:2017-06-01 00:00:00

  • Glyceraldehyde-3-phosphate dehydrogenase gene diversity in eubacteria and eukaryotes: evidence for intra- and inter-kingdom gene transfer.

    abstract::Cyanobacteria contain up to three highly divergent glyceraldehyde-3-phosphate dehydrogenase (GAPDH) genes: gap1, gap2, and gap3. Genes gap1 and gap2 are closely related at the sequence level to the nuclear genes encoding cytosolic and chloroplast GAPDH of higher plants and have recently been shown to play distinct key...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a026125

    authors: Figge RM,Schubert M,Brinkmann H,Cerff R

    更新日期:1999-04-01 00:00:00

  • Myxosporea (Myxozoa, Cnidaria) Lack DNA Cytosine Methylation.

    abstract::DNA cytosine methylation is central to many biological processes, including regulation of gene expression, cellular differentiation, and development. This DNA modification is conserved across animals, having been found in representatives of sponges, ctenophores, cnidarians, and bilaterians, and with very few known ins...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msaa214

    authors: Kyger R,Luzuriaga-Neira A,Layman T,Milkewitz Sandberg TO,Singh D,Huchon D,Peri S,Atkinson SD,Bartholomew JL,Yi SV,Alvarez-Ponce D

    更新日期:2021-01-23 00:00:00

  • MosquI, a novel family of mosquito retrotransposons distantly related to the Drosophila I factors, may consist of elements of more than one origin.

    abstract::A novel family of non-long-terminal-repeat (non-LTR) retrotransposons, named MosquI, was discovered in the yellow fever mosquito, Aedes aegypti. There were approximately 14 copies of MosquI in the A. aegypti genome. Four of the five analyzed MosquI elements were truncated at the 5' ends while one of them, MosquI-Aa2, ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a026081

    authors: Tu Z,Hill JJ

    更新日期:1999-12-01 00:00:00

  • A New Formulation of Random Genetic Drift and Its Application to the Evolution of Cell Populations.

    abstract::Random genetic drift, or stochastic change in gene frequency, is a fundamental evolutionary force that is usually defined within the ideal Wright-Fisher (WF) population. However, as the theory is increasingly applied to populations that deviate strongly from the ideal model, a paradox of random drift has emerged. When...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msx161

    authors: Chen Y,Tong D,Wu CI

    更新日期:2017-08-01 00:00:00

  • Positive and negative selection in murine ultraconserved noncoding elements.

    abstract::There are many more selectively constrained noncoding than coding nucleotides in the mammalian genome, but most mammalian noncoding DNA is subject to weak selection, on average. One of the most striking discoveries to have emerged from comparisons among mammalian genomes is the hundreds of noncoding elements of more t...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msr093

    authors: Halligan DL,Oliver F,Guthrie J,Stemshorn KC,Harr B,Keightley PD

    更新日期:2011-09-01 00:00:00

  • Mitochondrial genome of the colorless green alga Polytomella parva: two linear DNA molecules with homologous inverted repeat Termini.

    abstract::Most of the well-characterized mitochondrial genomes from diverse green algal lineages are circular mapping DNA molecules; however, Chlamydomonas reinhardtii has a linear 15.8 kb unit mitochondrial genome with 580 or 581 bp inverted repeat ends. In mitochondrial-enriched fractions prepared from Polytomella parva (=P. ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/oxfordjournals.molbev.a004180

    authors: Fan J,Lee RW

    更新日期:2002-07-01 00:00:00

  • Testing whether metazoan tyrosine loss was driven by selection against promiscuous phosphorylation.

    abstract::Protein tyrosine phosphorylation is a key regulatory modification in metazoans, and the corresponding kinase enzymes have diversified dramatically. This diversification is correlated with a genome-wide reduction in protein tyrosine content, and it was recently suggested that this reduction was driven by selection to a...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msu284

    authors: Pandya S,Struck TJ,Mannakee BK,Paniscus M,Gutenkunst RN

    更新日期:2015-01-01 00:00:00

  • Molecular evolution of the ligands of the insulin-signaling pathway: dilp genes in the genus Drosophila.

    abstract::Drosophila melanogaster, unlike mammals, has seven insulin-like peptides (DILPS). In Drosophila, all seven genes (dilp1-7) are single copy in the 12 species studied, except for D. grimshawi with two tandem copies of dilp2. Our comparative analysis revealed that genes dilp1-dilp7 exhibit differential functional constra...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msq353

    authors: Guirao-Rico S,Aguadé M

    更新日期:2011-05-01 00:00:00

  • Gene Tree Discordance Can Generate Patterns of Diminishing Convergence over Time.

    abstract::Phenotypic convergence is an exciting outcome of adaptive evolution, occurring when different species find similar solutions to the same problem. Unraveling the molecular basis of convergence provides a way to link genotype to adaptive phenotypes, but can also shed light on the extent to which molecular evolution is r...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msw197

    authors: Mendes FK,Hahn Y,Hahn MW

    更新日期:2016-12-01 00:00:00

  • Detecting Signatures of Positive Selection along Defined Branches of a Population Tree Using LSD.

    abstract::Identifying the genomic basis underlying local adaptation is paramount to evolutionary biology, and bears many applications in the fields of conservation biology, crop, and animal breeding, as well as personalized medicine. Although many approaches have been developed to detect signatures of positive selection within ...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msy053

    authors: Librado P,Orlando L

    更新日期:2018-06-01 00:00:00

  • Zisupton--a novel superfamily of DNA transposable elements recently active in fish.

    abstract::Transposable elements are widespread mobile DNA sequences able to integrate into new locations within genomes. Through transposition and recombination, they significantly contribute to genome plasticity and evolution. They can also regulate gene expression and provide regulatory and coding sequences (CDSs) for the evo...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msr208

    authors: Böhne A,Zhou Q,Darras A,Schmidt C,Schartl M,Galiana-Arnoux D,Volff JN

    更新日期:2012-02-01 00:00:00

  • Performance of a new invariants method on homogeneous and nonhomogeneous quartet trees.

    abstract::An attempt to use phylogenetic invariants for tree reconstruction was made at the end of the 80s and the beginning of the 90s by several researchers (the initial idea due to Lake [1987] and Cavender and Felsenstein [1987]). However, the efficiency of methods based on invariants is still in doubt (Huelsenbeck 1995; Jin...

    journal_title:Molecular biology and evolution

    pub_type: 杂志文章

    doi:10.1093/molbev/msl153

    authors: Casanellas M,Fernández-Sánchez J

    更新日期:2007-01-01 00:00:00