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Record W2954272163 · doi:10.1096/fj.201900140r

Structure‐guided probing of the leukotriene C <sub>4</sub> binding site in human multidrug resistance protein 1 (MRP1; ABCC1)

2019· article· en· W2954272163 on OpenAlexafffund
Gwenaëlle Conseil, May Arama-Chayoth, Yossi Tsfadia, Susan P.C. Cole

Bibliographic record

VenueThe FASEB Journal · 2019
Typearticle
Languageen
FieldMedicine
TopicDrug Transport and Resistance Mechanisms
Canadian institutionsQueen's UniversityOntario Institute for Cancer Research
FundersCanadian Institutes of Health ResearchNational Institutes of Health
KeywordsABCC1Leukotriene C4ChemistryGlutathioneBinding siteATP-binding cassette transporterLeukotrieneMultiple drug resistanceTransport proteinMultidrug resistance-associated protein 2Multidrug Resistance-Associated ProteinsBiochemistryPlasma protein bindingTransporterBiologyGene

Abstract

fetched live from OpenAlex

ABSTRACT The human multidrug resistance protein 1 (hMRP1) transporter is implicated in cancer multidrug resistance as well as immune responses involving its physiologic substrate, glutathione (GSH)‐conjugated leukotriene C 4 (LTC 4 ). LTC 4 binds a bipartite site on hMRP1, which a recent cryoelectron microscopy structure of LTC 4 ‐bound bovine Mrp1 depicts as composed of a positively charged pocket and a hydrophobic (H) pocket that binds the GSH moiety and surrounds the fatty acid moiety, respectively, of LTC 4 . Here, we show that single Ala and Leu substitutions of H‐pocket hMRP1‐Met 1093 have no effect on LTC 4 binding or transport. Estrone 3‐sulfate transport is also unaffected, but both hMRP1‐Met 1093 mutations eliminate estradiol glucuronide transport, demonstrating that these steroid conjugates have binding sites distinct from each other and from LTC 4 . To eliminate LTC 4 transport by hMRP1, mutation of 3 H‐pocket residues was required (W553/M1093/W1246A), indicating that H‐pocket amino acids are key to the vastly different affinities of hMRP1 for LTC 4 vs . GSH alone. Unlike organic anion transport, hMRP1‐mediated drug resistance was more diminished by Ala than Leu substitution of Met 1093 . Although our findings generally support a structure in which H‐pocket residues bind the lipid tail of LTC 4 , their critical and differential role in the transport of conjugated estrogens and anticancer drugs remains unexplained.—Conseil, G., Arama‐Chayoth, M., Tsfadia, Y., Cole, S. P. C. Structure‐guided probing of the leukotriene C 4 binding site in human multidrug resistance protein 1 (MRP1; ABCC1). FA8EB J. 33, 10692–10704 (2019). www.fasebj.org

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 distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation 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 score0.009
Threshold uncertainty score0.482

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
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 integrity0.0000.001
Insufficient payload (model declined to judge)0.0000.000

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 head0.011
GPT teacher head0.231
Teacher spread0.220 · 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 teacher head, 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

Citations27
Published2019
Admission routes2
Has abstractyes

Explore more

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