Evidence map›Paper›PMID 22984805›Full record

ArticleInorganic chemistry2012

1H-ENDOR evidence for a hydrogen-bonding interaction that modulates the reactivity of a nonheme Fe(IV)═O unit.

Muralidharan Shanmugam, Genqiang Xue, Lawrence Que, Brian M Hoffman

Abstract read
In one paragraph

Article in Inorganic chemistry, 2012. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers.

0numbers the graph read from it
0cells of the map it votes in
5citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

5 citing papers in PubMed.

  1. Review
  2. Design of Heteronuclear Metalloenzymes.Methods in enzymology · 2016
    Article
  3. Article
  4. Article
  5. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

4 authors.

Muralidharan ShanmugamDepartment of Chemistry, Northwestern University, Evanston, Illinois 60208-3113, USA.
Genqiang Xue
Lawrence Que
Brian M Hoffman

Funding

COBOGLOBINS: COBALT-SUBSTITUTED MYO- AND HEMOGLOBINSR01HL013531 · NHLBI · NORTHWESTERN UNIVERSITY · PI HOFFMAN, BRIAN M · 1985 to 2013
$7.7M
Synthetic Models and Spectroscopy of Nonheme Diiron EnzymesR01GM038767 · NIGMS · UNIVERSITY OF MINNESOTA TWIN CITIES · PI QUE, LAWRENCE · 1987 to 2018
$5.8M
COBOGLOBINS: COBALT-SUBSTITUTED MYO- AND HEMOGLOBINSR37HL013531 · NHLBI · NORTHWESTERN UNIVERSITY · PI HOFFMAN, BRIAN M · 1989 to 1998
–
NHLBI NIH HHS HL 13531NHLBI NIH HHS R01 HL013531NIGMS NIH HHS GM38767NIGMS NIH HHS R01 GM038767
6 · The paper itself

Abstract

We report that a novel use of 35 GHz (1)H-ENDOR spectroscopy establishes the presence in 1 of an Fe(IV)═O···H-O-Fe(III) hydrogen bond predicted by density functional theory computations to generate a six-membered-ring core for 1. The hydrogen bond rationalizes the difference in the C-H bond cleavage reactivity between 1 and 4(OCH(3)) (where a CH(3)O group has replaced the HO on the Fe(III) site). This result substantiates the seemingly paradoxical conclusion that the nonheme Fe(IV)═O unit of 1 not only has the electrophilic character required for H-atom abstraction but also retains sufficient nucleophilic character to accept a hydrogen bond from the Fe(III)-OH unit.

Indexed as

Electron Spin Resonance SpectroscopyFerric CompoundsHydrogen BondingIron CompoundsModels, MolecularOxygenFerric CompoundsIron CompoundsOxygen

Identifiers

PMID22984805
PMCPMC3482979

What OpenQuestion holds

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Registered trials

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.