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Record W2009492274 · doi:10.1021/jp000452y

Distal Interactions in the Cyanide Complex of Ferric <i>Chlamydomonas</i> Hemoglobin

2000· article· en· W2009492274 on OpenAlexaff
Tapan K. Das, Manon Couture, Michel Guertin, Denis L. Rousseau

Bibliographic record

VenueThe Journal of Physical Chemistry B · 2000
Typearticle
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicHemoglobin structure and function
Canadian institutionsUniversité Laval
Fundersnot available
KeywordsHemeCyanideChemistryGlobinHemoglobinWild typeMutantFerricResonance Raman spectroscopyCrystallographyChlamydomonasChlamydomonas reinhardtiiHemeproteinResonance (particle physics)FerrousPhotochemistryAdductStereochemistryNuclear magnetic resonanceRaman spectroscopyBiochemistryInorganic chemistryOrganic chemistryGene

Abstract

fetched live from OpenAlex

Chlamydomonas hemoglobin is expressed in chloroplast during active photosynthesis. Its heme pocket has an unusual structure that undergoes substantial changes when exogenous ligands bind the heme iron. In the ferrous state of the heme, oxygen binds with high affinity and is stabilized by interactions from E7-glutamine and B10-tyrosine. In the present study, we have examined cyanide binding to the ferric heme by resonance Raman spectroscopy. The frequency of the Fe−CN stretching mode in the wild-type protein was assigned at 440 cm -1, which is significantly lower than that observed in other globins. Another cyanide isotope sensitive mode located at 315 cm -1 is tentatively assigned as an Fe(III)−His stretching mode in the six-coordinate CN adduct. To determine the sensitivity of the Fe−CN stretching mode to the interactions in the distal pocket, we also studied three distal pocket mutants. The frequency of the Fe−CN stretching mode in the cyanide complex of the Lys87Ala (E10) mutant was nearly identical to that of the wild-type protein but it increased to 452 cm -1 for the Gln84Gly (E7) mutant. In the Tyr63Leu (B10) mutant, the frequency of the Fe−CN stretching mode decreased by 5 cm -1 relative to that in the wild type. On the basis of the low frequency for the Fe−CN stretching mode in the wild-type protein and its smaller than expected cyanide isotope shift (4 cm -1 compared to 11 cm -1 expected for a two-body Fe−CN oscillator) we propose a highly bent Fe−C−N structure in Chlamydomonas hemoglobin, in sharp contrast to the widely accepted linear cyanide structure in most vertebrate globins. The occurrence of a bent cyanide structure in Chlamydomonas hemoglobin is likely caused by a congested distal cavity resulting in a strong steric interaction between the E7-glutamine residue and the heme-bound cyanide.

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 score0.005
Threshold uncertainty score0.010

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 integrity0.0000.000
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 head0.010
GPT teacher head0.261
Teacher spread0.251 · 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

Citations23
Published2000
Admission routes1
Has abstractyes

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