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Record W2231037201 · doi:10.1139/cjc-2015-0375

Formation of Hg(II) tetrathiolate complexes with cysteine at neutral pH

2016· article· en· W2231037201 on OpenAlexafffundvenue
Thomas G. Warner, Farideh Jalilehvand

Bibliographic record

VenueCanadian Journal of Chemistry · 2016
Typearticle
Languageen
FieldChemistry
TopicMolecular Sensors and Ion Detection
Canadian institutionsUniversity of Calgary
FundersSLAC National Accelerator LaboratoryBasic Energy SciencesNational Institute of General Medical SciencesBiological and Environmental ResearchNatural Sciences and Engineering Research Council of CanadaOffice of ScienceNational Institutes of HealthU.S. Department of Energy
KeywordsChemistryCysteineAqueous solutionInorganic chemistryMercury (programming language)MoleRaman spectroscopyNuclear chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

Mercury(II) ions precipitate from aqueous cysteine (H 2 Cys) solutions containing H 2 Cys/Hg(II) mole ratio ≥ 2.0 as Hg(S-HCys) 2 . In the absence of additional cysteine, the precipitate dissolves at pH ∼12 with the [Hg(S,N-Cys) 2 ] 2– complex dominating. With excess cysteine (H 2 Cys/Hg(II) mole ratio ≥ 4.0), higher complexes form and the precipitate dissolves at lower pH values. Previously, we found that tetrathiolate [Hg(S-Cys) 4 ] 6– complexes form at pH = 11.0; in this work, we extend the investigation to pH values of physiological interest. We examined two series of Hg(II)–cysteine solutions in which C Hg(II) varied between 8 and 9 mmol/L and 80 and 100 mmol/L, respectively, with H 2 Cys/Hg(II) mole ratios from 4 to ∼20. The solutions were prepared in the pH range 7.1–8.8 at the pH at which the initial Hg(S-HCys) 2 precipitate dissolved. The variations in the Hg(II) speciation were followed by 199 Hg NMR, X-ray absorption, and Raman spectroscopic techniques. Our results show that in the dilute solutions (C Hg(II) = 8–9 mmol/L), mixtures of di-, tri- (major), and tetrathiolate complexes exist at moderate cysteine excess (C H2Cys ∼0.16 mol/L) at pH 7.1. In the more concentrated solutions (C Hg(II) = 80–100 mmol/L) with high cysteine excess (C H2Cys > 0.9 mol/L), tetrathiolate [Hg(S-cysteinate) 4 ] m − 6 (m = 0–4) complexes dominate in the pH range 7.3–7.8, with lower charge than for the [Hg(S-Cys) 4 ] 6– complex due to protonation of some (m) of the amino groups of the coordinated cysteine ligands. The results of this investigation could provide a key to the mechanism of biosorption and accumulation of Hg(II) ions in biological/environmental systems.

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)0.000
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 score0.891

Codex and Gemma teacher scores by category

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 integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

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 head0.007
GPT teacher head0.178
Teacher spread0.171 · 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

Citations22
Published2016
Admission routes3
Has abstractyes

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