Related references
Note: Only part of the references are listed.Reaction Mechanism of Cytochrome c Oxidase
Shinya Yoshikawa et al.
CHEMICAL REVIEWS (2015)
Broken Symmetry DFT Calculations/Analysis for Oxidized and Reduced Dinuclear Center in Cytochrome c Oxidase: Relating Structures, Protonation States, Energies, and Mossbauer Properties in ba3 Thermus thermophilus
Wen-Ge Han Du et al.
INORGANIC CHEMISTRY (2015)
A Naked FeIII-(O22-)-CuII Species Allows for Structural and Spectroscopic Tuning of Low-Spin Heme-Peroxo-Cu Complexes
Isaac Garcia-Bosch et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2015)
Mutation of a single residue in the ba3 oxidase specifically impairs protonation of the pump site
Christoph von Ballmoos et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2015)
Linking Chemical Electron Proton Transfer to Proton Pumping in Cytochrome c Oxidase: Broken-Symmetry DFT Exploration of Intermediates along the Catalytic Reaction Pathway of the Iron-Copper Dinuclear Complex
Louis Noodleman et al.
INORGANIC CHEMISTRY (2014)
Computational electrochemistry: prediction of liquid-phase reduction potentials
Aleksandr V. Marenich et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Density Functional Study for the Bridged Dinuclear Center Based on a High-Resolution X-ray Crystal Structure of ba3 Cytochrome c Oxidase from Thermus thermophilus
Wen-Ge Han Du et al.
INORGANIC CHEMISTRY (2013)
Spectroscopic Elucidation of a New Heme/Copper Dioxygen Structure Type: Implications for O•••O Bond Rupture in Cytochrome c Oxidase
Matthew T. Kieber-Emmons et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)
Active site intermediates in the reduction of O2 by cytochrome oxidase, and their derivatives
Marten Wikstrom
BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS (2012)
Proton transfer in ba3 cytochrome c oxidase from Thermus thermophilus
Christoph von Ballmoos et al.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS (2012)
Cytochrome c oxidase: Intermediates of the catalytic cycle and their energy-coupled interconversion
Alexander A. Konstantinov
FEBS LETTERS (2012)
Exploring the proton pump and exit pathway for pumped protons in cytochrome ba3 from Thermus thermophilus
Hsin-Yang Chang et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2012)
The identity of the transient proton loading site of the proton-pumping mechanism of cytochrome c oxidase
Ville R. I. Kaila et al.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS (2011)
Electronic Structure of a Low-Spin Heme/Cu Peroxide Complex: Spin-State and Spin-Topology Contributions to Reactivity
Matthew T. Kieber-Emmons et al.
INORGANIC CHEMISTRY (2011)
High Resolution Structure of the ba3 Cytochrome c Oxidase from Thermus thermophilus in a Lipidic Environment
Theresa Tiefenbrunn et al.
PLOS ONE (2011)
Proton-Coupled Electron Transfer in Cytochrome Oxidase
Ville R. I. Kaila et al.
CHEMICAL REVIEWS (2010)
Heme-Copper-Dioxygen Complexes: Toward Understanding Ligand-Environmental Effects on the Coordination Geometry, Electronic Structure, and Reactivity
Zakaria Halime et al.
INORGANIC CHEMISTRY (2010)
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
Stefan Grimme et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Performance of CASPT2 and DFT for Relative Spin-State Energetics of Heme Models
Steven Vancoillie et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2010)
CO impedes superfast O2 binding in ba3 cytochrome oxidase from Thermus thermophilus
Istvan Szundi et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2010)
Combined Microspectrophotometric and Crystallographic Examination of Chemically Reduced and X-ray Radiation-Reduced Forms of Cytochrome ba3 Oxidase from Thermus thermophilus: Structure of the Reduced Form of the Enzymes
Bin Liu et al.
BIOCHEMISTRY (2009)
High resolution crystal structure of Paracoccus denitrificans cytochrome c oxidase: New insights into the active site and the proton transfer pathways
Juergen Koepke et al.
BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS (2009)
A peroxide bridge between Fe and Cu ions in the O2 reduction site of fully oxidized cytochrome c oxidase could suppress the proton pump
Hiroshi Aoyama et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2009)
Crystallographic studies of Xe and Kr binding within the large internal cavity of cytochrome ba3 from Thermus thermophilus:: Structural analysis and role of oxygen transport channels in the heme-Cu oxidases
V. Mitch Luna et al.
BIOCHEMISTRY (2008)
Binding of CO, NO, and O2 to Heme by Density Functional and Multireference ab Initio Calculations
Mariusz Radon et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
Toward a Chemical Mechanism of Proton Pumping by the B-Type Cytochrome c Oxidases: Application of Density Functional Theory to Cytochrome ba3 of Thermus thermophilus
James A. Fee et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
The proton donor for O-O bond scission by cytochrome c oxidase
Elena A. Gorbikova et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2008)
Theoretical study on electronic structures of FeOO, FeOOH, FeO(H2O), and FeO in hemes:: As intermediate models of dioxygen reduction in cytochrome c oxidase
Yasunori Yoshioka et al.
JOURNAL OF INORGANIC BIOCHEMISTRY (2007)
Identification of conserved lipid/detergent-binding sites in a high-resolution structure of the membrane protein cytochrome c oxidase
Ling Qin et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2006)
Electron transfer among the CuA-, heme b- and a3-centers of Thermus thermophilus cytochrome ba3
Ole Farver et al.
FEBS LETTERS (2006)
A novel cryoprotection scheme for enhancing the diffraction of crystals of recombinant cytochrome ba3 oxidase from Thermus thermophilus
LM Hunsicker-Wang et al.
ACTA CRYSTALLOGRAPHICA SECTION D-STRUCTURAL BIOLOGY (2005)
A discrete water exit pathway in the membrane protein cytochrome c oxidase
B Schmidt et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2003)
Metal-bridging mechanism for O-O bond cleavage in cytochrome c oxidase
MRA Blomberg et al.
INORGANIC CHEMISTRY (2003)
The X-ray crystal structures of wild-type and EQ(I-286) mutant cytochrome c oxidases from Rhodobacter sphaeroides
M Svensson-Ek et al.
JOURNAL OF MOLECULAR BIOLOGY (2002)
Chemistry with ADF
G te Velde et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2001)
Modeling cytochrome oxidase:: A quantum chemical study of the O-O bond cleavage mechanism
MRA Blomberg et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Oxygen activation and reduction in respiration: Involvement of redox-active tyrosine 244
DA Proshlyakov et al.
SCIENCE (2000)
Structure and mechanism of the aberrant ba3-cytochrome c oxidase from Thermus thermophilus
T Soulimane et al.
EMBO JOURNAL (2000)