Structure, ligands and substrate coordination of the oxygen-evolving complex of photosystem II in the S2 state: a combined EPR and DFT study (Q44388430)

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scientific article published in June 2014

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English	Structure, ligands and substrate coordination of the oxygen-evolving complex of photosystem II in the S2 state: a combined EPR and DFT study	scientific article published in June 2014

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scholarly article

1 reference

Europe PubMed Central

2 December 2017

Structure, ligands and substrate coordination of the oxygen-evolving complex of photosystem II in the S2 state: a combined EPR and DFT study (English)

1 reference

Europe PubMed Central

2 December 2017

1 reference

based on heuristic

inferred from title

2

1 reference

Europe PubMed Central

2 December 2017

8

1 reference

Europe PubMed Central

2 December 2017

Dimitrios A. Pantazis

10

1 reference

Europe PubMed Central

2 December 2017

Thomas Lohmiller

object named as

Thomas Lohmiller

1

0 references

object named as

Marius Retegan

4

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object named as

Nicholas Cox

11

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Wolfgang Lubitz

9

object named as

Wolfgang Lubitz

1 reference

Europe PubMed Central

2 December 2017

Marc M Nowaczyk

object named as

Marc M Nowaczyk

6

0 references

7

object named as

Alain Boussac

1 reference

Europe PubMed Central

2 December 2017

author name string

Montserrat Pérez Navarro

3

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Europe PubMed Central

2 December 2017

Leonid Rapatskiy

5

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Europe PubMed Central

2 December 2017

language of work or name

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publication date

1 June 2014

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Europe PubMed Central

2 December 2017

number of pages

16

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based on heuristic

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Physical Chemistry Chemical Physics

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Europe PubMed Central

2 December 2017

16

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Europe PubMed Central

2 December 2017

24

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Europe PubMed Central

2 December 2017

11877-11892

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Europe PubMed Central

2 December 2017

UN NOUVEAU MODELE DES CENTRES PHOTOCHIMIQUES DU SYSTEME II

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Cooperation of charges in photosynthetic O2 evolution-I. A linear four step mechanism

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Water-splitting chemistry of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Reflections on substrate water and dioxygen formation.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Biological water oxidation

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Crystal structure of oxygen-evolving photosystem II at a resolution of 1.9 Å

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Simulations of the (1)H electron spin echo-electron nuclear double resonance and (2)H electron spin echo envelope modulation spectra of exchangeable hydrogen nuclei coupled to the S(2)-state photosystem II manganese cluster

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Theoretical evaluation of structural models of the S2 state in the oxygen evolving complex of Photosystem II: protonation states and magnetic interactions

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The structure and activation of substrate water molecules in the S2 state of photosystem II studied by hyperfine sublevel correlation spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Detection of the water-binding sites of the oxygen-evolving complex of Photosystem II using W-band 17O electron-electron double resonance-detected NMR spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Highly resolved proton matrix ENDOR of oriented photosystem II membranes in the S2 state.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

EPR spectroscopy of the manganese cluster of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Electron-nuclear double resonance

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The two forms of the S(2) state multiline signal in Photosystem II: effect of methanol and ethanol

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Intermediates of a polynuclear manganese center involved in photosynthetic oxidation of water

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Effect of near-infrared light on the S2-state of the manganese complex of photosystem II from Synechococcus elongatus.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Q-band EPR of the S2 state of photosystem II confirms an S = 5/2 origin of the X-band g = 4.1 signal

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Electronic structure of the Mn4OxCa cluster in the S0 and S2 states of the oxygen-evolving complex of photosystem II based on pulse 55Mn-ENDOR and EPR spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Electronic structure of the tyrosine D radical and the water-splitting complex from pulsed ENDOR spectroscopy on photosystem II single crystals.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Effect of Ca2+/Sr2+ substitution on the electronic structure of the oxygen-evolving complex of photosystem II: a combined multifrequency EPR, 55Mn-ENDOR, and DFT study of the S2 state

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The electronic structures of the S(2) states of the oxygen-evolving complexes of photosystem II in plants and cyanobacteria in the presence and absence of methanol

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

A new quantum chemical approach to the magnetic properties of oligonuclear transition-metal complexes: application to a model for the tetranuclear manganese cluster of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structure of the oxygen-evolving complex of photosystem II: information on the S(2) state through quantum chemical calculation of its magnetic properties.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Density functional calculations of (55)Mn, (14)N and (13)C electron paramagnetic resonance parameters support an energetically feasible model system for the S(2) state of the oxygen-evolving complex of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Two interconvertible structures that explain the spectroscopic properties of the oxygen-evolving complex of photosystem II in the S2 state.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

On the magnetic and spectroscopic properties of high-valent Mn3CaO4 cubanes as structural units of natural and artificial water-oxidizing catalysts.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Ammonia binding to the oxygen-evolving complex of photosystem II identifies the solvent-exchangeable oxygen bridge (μ-oxo) of the manganese tetramer

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Biosynthetic Ca2+/Sr2+ exchange in the photosystem II oxygen-evolving enzyme of Thermosynechococcus elongatus

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Binding of amines to the O2-evolving center of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The manganese site of the photosynthetic oxygen-evolving complex probed by EPR spectroscopy of oriented photosystem II membranes: the g = 4 and g = 2 multiline signals

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

EPR study of the oxygen evolving complex in His-tagged photosystem II from the cyanobacterium Synechococcus elongatus

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Ammonia displaces methanol bound to the water oxidizing complex of photosystem II in the S2 state

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

EPR signals from modified charge accumulation states of the oxygen evolving enzyme in Ca2+-deficient photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

A calcium-specific site influences the structure and activity of the manganese cluster responsible for photosynthetic water oxidation

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The basic properties of the electronic structure of the oxygen-evolving complex of photosystem II are not perturbed by Ca2+ removal

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Detection of one slowly exchanging substrate water molecule in the S3 state of photosystem II

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

On-line mass spectrometry: membrane inlet sampling

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Interaction and inhibitory effect of ammonium cation in the oxygen evolving center of photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Influence of histidine-198 of the D1 subunit on the properties of the primary electron donor, P680, of photosystem II in Thermosynechococcus elongatus

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Biosynthetic exchange of bromide for chloride and strontium for calcium in the photosystem II oxygen-evolving enzymes.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Functional characterization and quantification of the alternative PsbA copies in Thermosynechococcus elongatus and their role in photoprotection

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Deletion of psbJ leads to accumulation of Psb27-Psb28 photosystem II complexes in Thermosynechococcus elongatus

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

EasySpin, a comprehensive software package for spectral simulation and analysis in EPR.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Density-functional exchange-energy approximation with correct asymptotic behavior

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Density functional theory

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

An improvement of the resolution of the identity approximation for the formation of the Coulomb matrix.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Accurate Coulomb-fitting basis sets for H to Rn.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Magnetic and spectroscopic properties of mixed valence manganese(III,IV) dimers: a systematic study using broken symmetry density functional theory

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structures and energetics for O2 formation in photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

S1-state model of the O2-evolving complex of photosystem II

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Convergence of QM/MM and Cluster Models for the Spectroscopic Properties of the Oxygen-Evolving Complex in Photosystem II.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structure and orientation of the Mn4Ca cluster in plant photosystem II membranes studied by polarized range-extended x-ray absorption spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structural changes in the Mn4Ca cluster and the mechanism of photosynthetic water splitting

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

On the structure of the manganese complex of photosystem II: extended-range EXAFS data and specific atomic-resolution models for four S-states

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structure of Sr-substituted photosystem II at 2.1 A resolution and its implications in the mechanism of water oxidation

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Site-directed mutagenesis of Thermosynechococcus elongatus photosystem II: the O2-evolving enzyme lacking the redox-active tyrosine D.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Structural consequences of ammonia binding to the manganese center of the photosynthetic oxygen-evolving complex: an X-ray absorption spectroscopy study of isotropic and oriented photosystem II particles

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

g-Anisotropy of the S2-state manganese cluster in single crystals of cyanobacterial photosystem II studied by W-band electron paramagnetic resonance spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Multifrequency electron spin-echo envelope modulation studies of nitrogen ligation to the manganese cluster of photosystem II

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Ligation of D1-His332 and D1-Asp170 to the manganese cluster of photosystem II from Synechocystis assessed by multifrequency pulse EPR spectroscopy

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Does histidine 332 of the D1 polypeptide ligate the manganese cluster in photosystem II? An electron spin echo envelope modulation study

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Multifrequency pulsed electron paramagnetic resonance study of the S2 state of the photosystem II manganese cluster

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Cyanobacterial photosystem II at 2.9-A resolution and the role of quinones, lipids, channels and chloride

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

The dimanganese(III,IV) oxidation state of catalase from Thermus thermophilus: electron nuclear double resonance analysis of water and protein ligands in the active site

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Calculating the electron paramagnetic resonance parameters of exchange coupled transition metal complexes using broken symmetry density functional theory: application to a MnIII/MnIV model compound.

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Multifrequency EPR studies of manganese catalases provide a complete description of proteinaceous nitrogen coordination

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Prediction of molecular properties and molecular spectroscopy with density functional theory: From fundamental theory to exchange-coupling

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Electronic Structure of a Weakly Antiferromagnetically Coupled MnIIMnIIIModel Relevant to Manganese Proteins: A Combined EPR,55Mn-ENDOR, and DFT Study

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Efficient, approximate and parallel Hartree–Fock and hybrid DFT calculations. A ‘chain-of-spheres’ algorithm for the Hartree–Fock exchange

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Electronic Structure of Antiferromagnetically Coupled Dinuclear Manganese (MnIIIMnIV) Complexes Studied by Magnetic Resonance Techniques

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Dimanganese catalase—spectroscopic parameters from broken-symmetry density functional theory of the superoxidized MnIII/MnIV state

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Histidine oxidation in the oxygen-evolving photosystem-II enzyme

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Theoretical EXAFS studies of a model of the oxygen-evolving complex of photosystem II obtained with the quantum cluster approach

1 reference

https://api.crossref.org/works/10.1039%2FC3CP55017F

21 January 2018

Identifiers

10.1039/C3CP55017F

1 reference

Europe PubMed Central

2 December 2017

1 reference

Europe PubMed Central

2 December 2017

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