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Record W2335534559 · doi:10.17952/24aps.2015.047

Design and Synthesis of Lasso-Inspired Peptides with Antibacterial Activity

2015· article· en· W2335534559 on OpenAlexafffund
François Bédard, Riadh Hammami, Ahmed M. Gomaa, Muriel Subirade, Ismaı̈l Fliss, Éric Biron

Bibliographic record

Venuenot available
Typearticle
Languageen
FieldMedicine
TopicMicrobial Natural Products and Biosynthesis
Canadian institutionsCentre hospitalier de l'Université LavalCentre hospitalier universitaire de QuébecUniversité Laval
FundersFonds de recherche du Québec – Nature et technologiesNatural Sciences and Engineering Research Council of CanadaFonds Québécois de la Recherche sur la Nature et les Technologies
KeywordsComputer scienceLasso (programming language)Antibacterial activityCombinatorial chemistryArtificial intelligenceTheoretical computer scienceChemistryProgramming languageBiologyBacteria

Abstract

fetched live from OpenAlex

Microcin J25 (MccJ25) is a 21-residue ribosomally synthesized bactericidal peptide produced by Escherichia coli strains with an unusual lariat protoknot structure [1]. MccJ25 exhibits bactericidal activity toward several Gram-negative food-borne pathogens, including Salmonella, Shigella and E. coli [2]. The particular lasso topology of MccJ25 makes the peptide highly resistant to denaturation by high temperatures or proteolysis. These are attractive properties to both pharmaceutical and food industries. MccJ25 structure consists of an 8-residue cycle (lariat ring) formed by a lactam bond between the N-terminal amine and the Glu side chain, which is followed by a 13-residue tail that loops back to thread through the ring (Figure 1). The C-terminal tail (residues 9-21) of the peptide is tightly trapped in the lariat ring due to the presence of two aromatic side chains at positions 19 and 20. RNA polymerase appears to be the principal intracellular target of MccJ25 but other mode of actions have also been identified including inhibition of the respiratory chain [3-5]. SAR studies by site-directed mutagenesis revealed that the inhibitory activity of MccJ25 tolerates a number of residue substitutions [6]. Recent attempts to produce the lasso structure of MccJ25 by chemical synthesis have not yielded successful microbial inhibitors. Nevertheless, two synthetic peptides derived from MccJ25 without lasso folding were found to be bactericidal [7]. The current lack of information on MccJ25 structure and its essential features for antimicrobial activity could be overcome by chemical engineering and computational studies. We hypothesized that lasso formation is important but not a prerequisite for the activity of MccJ25 and that it may be possible to obtain derivatives that are active without the lasso structure [8]. In this study, we report synthetic peptides based on the MccJ25 sequence but devoid of lasso folding yet retaining activity against bacteria (S. enterica and E. coli) and specific intracellular targets (RNA polymerase and the respiration chain).

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.001
Threshold uncertainty score0.005

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0010.001

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.031
GPT teacher head0.242
Teacher spread0.211 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations0
Published2015
Admission routes2
Has abstractyes

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