Vibrational dynamics of oxygenated heme proteins

Weiqiao Zeng; Alexander Barabanschikov; Ningyan Wang; Yi Lu; Jiyong Zhao; Wolfgang Sturhahn; E. Ercan Alp; J. Timothy Sage

doi:10.1039/c2cc31239e

Vibrational dynamics of oxygenated heme proteins

Weiqiao Zeng, Alexander Barabanschikov, Ningyan Wang, Yi Lu, Jiyong Zhao, Wolfgang Sturhahn, E. Ercan Alp, J. Timothy Sage

Research output: Contribution to journal › Article › peer-review

Abstract

Advanced spectroscopic techniques coupled with DFT calculations reveal the vibrational dynamics of the iron in stable dioxygen complexes with myoglobin and with a mutant engineered to model the catalytic site of heme-copper oxidases. The unprecedented level of detail will constrain computational modelling of reactions with oxygen.

Original language	English (US)
Pages (from-to)	6340-6342
Number of pages	3
Journal	Chemical Communications
Volume	48
Issue number	51
DOIs	https://doi.org/10.1039/c2cc31239e
State	Published - May 30 2012

ASJC Scopus subject areas

Catalysis
Electronic, Optical and Magnetic Materials
Ceramics and Composites
Chemistry(all)
Surfaces, Coatings and Films
Metals and Alloys
Materials Chemistry

Access to Document

10.1039/c2cc31239e

Fingerprint Dive into the research topics of 'Vibrational dynamics of oxygenated heme proteins'. Together they form a unique fingerprint.

Cite this

@article{3fae1f51281f4a6bbfbd76314a310725,

title = "Vibrational dynamics of oxygenated heme proteins",

abstract = "Advanced spectroscopic techniques coupled with DFT calculations reveal the vibrational dynamics of the iron in stable dioxygen complexes with myoglobin and with a mutant engineered to model the catalytic site of heme-copper oxidases. The unprecedented level of detail will constrain computational modelling of reactions with oxygen.",

author = "Weiqiao Zeng and Alexander Barabanschikov and Ningyan Wang and Yi Lu and Jiyong Zhao and Wolfgang Sturhahn and Alp, {E. Ercan} and Sage, {J. Timothy}",

year = "2012",

month = may,

day = "30",

doi = "10.1039/c2cc31239e",

language = "English (US)",

volume = "48",

pages = "6340--6342",

journal = "Chemical Communications",

issn = "1359-7345",

publisher = "Royal Society of Chemistry",

number = "51",

}

TY - JOUR

T1 - Vibrational dynamics of oxygenated heme proteins

AU - Zeng, Weiqiao

AU - Barabanschikov, Alexander

AU - Wang, Ningyan

AU - Lu, Yi

AU - Zhao, Jiyong

AU - Sturhahn, Wolfgang

AU - Alp, E. Ercan

AU - Sage, J. Timothy

PY - 2012/5/30

Y1 - 2012/5/30

N2 - Advanced spectroscopic techniques coupled with DFT calculations reveal the vibrational dynamics of the iron in stable dioxygen complexes with myoglobin and with a mutant engineered to model the catalytic site of heme-copper oxidases. The unprecedented level of detail will constrain computational modelling of reactions with oxygen.

AB - Advanced spectroscopic techniques coupled with DFT calculations reveal the vibrational dynamics of the iron in stable dioxygen complexes with myoglobin and with a mutant engineered to model the catalytic site of heme-copper oxidases. The unprecedented level of detail will constrain computational modelling of reactions with oxygen.

UR - http://www.scopus.com/inward/record.url?scp=84862177653&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=84862177653&partnerID=8YFLogxK

U2 - 10.1039/c2cc31239e

DO - 10.1039/c2cc31239e

M3 - Article

AN - SCOPUS:84862177653

VL - 48

SP - 6340

EP - 6342

JO - Chemical Communications

JF - Chemical Communications

SN - 1359-7345

IS - 51

ER -