Evidence map›Paper›PMID 31127106›Full record

ArticleNature communications2019

Proton mediated spin state transition of cobalt heme analogs.

Jianping Zhao, Qian Peng, Zijian Wang, Wei Xu, Hongyan Xiao, Qi Wu, Hao-Ling Sun, Fang Ma, Jiyong Zhao, Cheng-Jun Sun and 2 more

Erratum issuedAbstract read
In one paragraph

Article in Nature communications, 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. An erratum has been issued. Cited by 7 papers.

0numbers the graph read from it
0cells of the map it votes in
7citing 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

7 citing papers in PubMed.

  1. Article
  2. Review
  3. Article
  4. Article
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4 · The record

Corrections and comments

5 · Who and what money

Authors and funding

12 authors.

Jianping ZhaoCollege of Materials Science and Opto-electronic Technology, CAS Center for Excellence in Topological Quantum Computation, & Center of Materials Science and Optoelectronics Engineering, University of Chinese Academy of Sciences, Yanqi Lake, Huairou District, 101408, Beijing, China.
Qian PengState Key Laboratory and Institute of Elemento-Organic Chemistry, College of Chemistry, Nankai University, 300071, Tianjin, China.ORCID http://orcid.org/0000-0002-1218-5976
Zijian WangState Key Laboratory and Institute of Elemento-Organic Chemistry, College of Chemistry, Nankai University, 300071, Tianjin, China.
Wei XuInstitute of High Energy Physics & University of Chinese Academy of Sciences, Chinese Academy of Sciences, 100049, Beijing, China.ORCID http://orcid.org/0000-0001-8006-2399
Hongyan XiaoKey Laboratory of Photochemical Conversion and Optoelectronic Materials, Technical Institute of Physics and Chemistry, Chinese Academy of Sciences, 100190, Beijing, China.ORCID http://orcid.org/0000-0003-1058-9149
Qi WuCollege of Materials Science and Opto-electronic Technology, CAS Center for Excellence in Topological Quantum Computation, & Center of Materials Science and Optoelectronics Engineering, University of Chinese Academy of Sciences, Yanqi Lake, Huairou District, 101408, Beijing, China.
Hao-Ling SunDepartment of Chemistry and Beijing Key Laboratory of Energy Conversion and Storage Materials, Beijing Normal University, 100875, Beijing, China.
Fang MaDepartment of Chemistry and Beijing Key Laboratory of Energy Conversion and Storage Materials, Beijing Normal University, 100875, Beijing, China.
Jiyong ZhaoAdvanced Photon Source, Argonne National Laboratory, Argonne, IL, 60439, USA.
Cheng-Jun SunAdvanced Photon Source, Argonne National Laboratory, Argonne, IL, 60439, USA.
Jianzhang ZhaoState Key Laboratory of Fine Chemicals, School of Chemical Engineering, Dalian University of Technology, West Campus, 2 Ling-Gong Road, 116024, Dalian, China.
Jianfeng LiCollege of Materials Science and Opto-electronic Technology, CAS Center for Excellence in Topological Quantum Computation, & Center of Materials Science and Optoelectronics Engineering, University of Chinese Academy of Sciences, Yanqi Lake, Huairou District, 101408, Beijing, China. jfli@ucas.ac.cn.ORCID http://orcid.org/0000-0002-4876-8970

Funding

National Natural Science Foundation of China (National Science Foundation of China) 21702109National Natural Science Foundation of China (National Science Foundation of China) 21771176
6 · The paper itself

Abstract

The spin state transition from low spin to high spin upon substrate addition is one of the key steps in cytochrome P450 catalysis. External perturbations such as pH and hydrogen bonding can also trigger the spin state transition of hemes through deprotonated histidine (e.g. Cytochrome c). In this work, we report the isolated 2-methylimidazole Cobalt(II) [Co(TPP)(2-MeHIm)] and [Co(TTP)(2-MeHIm)], and the corresponding 2-methylimidazolate derivatives where the N-H proton of axial 2-MeHIm is removed. Interestingly, various spectroscopies including EPR and XAFS determine a high-spin state (S = 3/2) for the imidazolate derivatives, in contrast to the low-spin state (S = 1/2) of all known imidazole analogs. DFT assisted stereoelectronic investigations are applied to understand the metal-ligand interactions, which suggest that the dramatically displaced metal center allowing a promotion e

Indexed as

ProtonsBiocatalysisCobaltCrystallography, X-RayCytochrome P-450 Enzyme SystemElectron Spin Resonance SpectroscopyHemeHistidineHydrogen-Ion ConcentrationImidazolesIronLigandsOxidation-ReductionCobaltCytochrome P-450 Enzyme SystemHemeHistidineimidazoleImidazolesIronLigandsProtons

Identifiers

PMID31127106
PMCPMC6534676

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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.