标题
Metal oxidation states in biological water splitting
作者
关键词
-
出版物
Chemical Science
Volume 6, Issue 3, Pages 1676-1695
出版商
Royal Society of Chemistry (RSC)
发表日期
2015-01-09
DOI
10.1039/c4sc03720k
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- Substrate water exchange in photosystem II core complexes of the extremophilic red alga Cyanidioschyzon merolae
- (2014) Håkan Nilsson et al. BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- PSII manganese cluster: Protonation of W2, O5, O4 and His337 in the S1 state explored by combined quantum chemical and electrostatic energy computations
- (2014) Arturo Robertazzi et al. BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- Mn4Ca Cluster in Photosynthesis: Where and How Water is Oxidized to Dioxygen
- (2014) Junko Yano et al. CHEMICAL REVIEWS
- Artificial Photosynthesis: Molecular Systems for Catalytic Water Oxidation
- (2014) Markus D. Kärkäs et al. CHEMICAL REVIEWS
- Molecular artificial photosynthesis
- (2014) Serena Berardi et al. CHEMICAL SOCIETY REVIEWS
- On Ammonia Binding to the Oxygen-Evolving Complex of Photosystem II: A Quantum Chemical Study
- (2014) Johannes Schraut et al. CHEMISTRY-A EUROPEAN JOURNAL
- Mn K-Edge X-ray Absorption Studies of Oxo- and Hydroxo-manganese(IV) Complexes: Experimental and Theoretical Insights into Pre-Edge Properties
- (2014) Domenick F. Leto et al. INORGANIC CHEMISTRY
- Valence-to-Core-Detected X-ray Absorption Spectroscopy: Targeting Ligand Selectivity
- (2014) Eleanor R. Hall et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Serial time-resolved crystallography of photosystem II using a femtosecond X-ray laser
- (2014) Christopher Kupitz et al. NATURE
- Native structure of photosystem II at 1.95 Å resolution viewed by femtosecond X-ray pulses
- (2014) Michihiro Suga et al. NATURE
- Electronic structure of the oxygen evolving complex in photosystem II, as revealed by 55Mn Davies ENDOR studies at 2.5 K
- (2014) Lu Jin et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Water oxidation energy diagrams for photosystem II for different protonation states, and the effect of removing calcium
- (2014) Per E. M. Siegbahn PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- The first tyrosyl radical intermediate formed in the S2–S3 transition of photosystem II
- (2014) Marius Retegan et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Structure, ligands and substrate coordination of the oxygen-evolving complex of photosystem II in the S2 state: a combined EPR and DFT study
- (2014) Thomas Lohmiller et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Pathway for Mn-cluster oxidation by tyrosine-Z in the S2 state of photosystem II
- (2014) D. Narzi et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Electronic structure of the oxygen-evolving complex in photosystem II prior to O-O bond formation
- (2014) N. Cox et al. SCIENCE
- Taking snapshots of photosynthetic water oxidation using femtosecond X-ray diffraction and spectroscopy
- (2014) Jan Kern et al. Nature Communications
- Biological Water Oxidation
- (2013) Nicholas Cox et al. ACCOUNTS OF CHEMICAL RESEARCH
- The S2State of the Oxygen-Evolving Complex of Photosystem II Explored by QM/MM Dynamics: Spin Surfaces and Metastable States Suggest a Reaction Path Towards the S3State
- (2013) Daniele Bovi et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Photosystem II: The Reaction Center of Oxygenic Photosynthesis
- (2013) David J. Vinyard et al. Annual Review of Biochemistry
- S0-State Model of the Oxygen-Evolving Complex of Photosystem II
- (2013) Rhitankar Pal et al. BIOCHEMISTRY
- Reflections on substrate water and dioxygen formation
- (2013) Nicholas Cox et al. BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- Energy and environment policy case for a global project on artificial photosynthesis
- (2013) Thomas A. Faunce et al. Energy & Environmental Science
- The Protonation States of Oxo-Bridged MnIV Dimers Resolved by Experimental and Computational Mn K Pre-Edge X-ray Absorption Spectroscopy
- (2013) Vera Krewald et al. INORGANIC CHEMISTRY
- Electronic Structural Changes of Mn in the Oxygen-Evolving Complex of Photosystem II during the Catalytic Cycle
- (2013) Pieter Glatzel et al. INORGANIC CHEMISTRY
- Structural Changes of the Oxygen-evolving Complex in Photosystem II during the Catalytic Cycle
- (2013) Carina Glöckner et al. JOURNAL OF BIOLOGICAL CHEMISTRY
- Convergence of QM/MM and Cluster Models for the Spectroscopic Properties of the Oxygen-Evolving Complex in Photosystem II
- (2013) Marius Retegan et al. Journal of Chemical Theory and Computation
- Solvent-Induced Luminescence Quenching: Static and Time-Resolved X-Ray Absorption Spectroscopy of a Copper(I) Phenanthroline Complex
- (2013) T. J. Penfold et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Substrate Water Exchange for the Oxygen Evolving Complex in PSII in the S1, S2, and S3 States
- (2013) Per E. M. Siegbahn JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- On the Magnetic and Spectroscopic Properties of High-Valent Mn3CaO4 Cubanes as Structural Units of Natural and Artificial Water-Oxidizing Catalysts
- (2013) Vera Krewald et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Entangled quantum electronic wavefunctions of the Mn4CaO5 cluster in photosystem II
- (2013) Yuki Kurashige et al. Nature Chemistry
- High-resolution molybdenum K-edge X-ray absorption spectroscopy analyzed with time-dependent density functional theory
- (2013) Frederico A. Lima et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Ammonia binding to the oxygen-evolving complex of photosystem II identifies the solvent-exchangeable oxygen bridge ( -oxo) of the manganese tetramer
- (2013) M. Perez Navarro et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Theoretical insight in to hydrogen-bonding networks and proton wire for the CaMn4O5 cluster of photosystem II. Elongation of Mn–Mn distances with hydrogen bonds
- (2013) M. Shoji et al. Catalysis Science & Technology
- The Artificial Leaf
- (2012) Daniel G. Nocera ACCOUNTS OF CHEMICAL RESEARCH
- Two Interconvertible Structures that Explain the Spectroscopic Properties of the Oxygen-Evolving Complex of Photosystem II in the S2State
- (2012) Dimitrios A. Pantazis et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Rationalizing the 1.9 Å Crystal Structure of Photosystem II-A Remarkable Jahn-Teller Balancing Act Induced by a Single Proton Transfer
- (2012) Phillip Gatt et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Water oxidation mechanism in photosystem II, including oxidations, proton release pathways, O―O bond formation and O2 release
- (2012) Per E.M. Siegbahn BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- What Are the Oxidation States of Manganese Required To Catalyze Photosynthetic Water Oxidation?
- (2012) Derrick R.J. Kolling et al. BIOPHYSICAL JOURNAL
- Which oxidation state is preferable at S0 state in oxygen-evolving complex, Mn4(II, III, IV, IV) or Mn4(III, III, III, IV)? A B3LYP study
- (2012) Tomoya Ichino et al. CHEMICAL PHYSICS LETTERS
- Theoretical illumination of water-inserted structures of the CaMn4O5 cluster in the S2 and S3 states of oxygen-evolving complex of photosystem II: full geometry optimizations by B3LYP hybrid density functional
- (2012) H. Isobe et al. DALTON TRANSACTIONS
- What spectroscopy reveals concerning the Mn oxidation levels in the oxygen evolving complex of photosystem II: X-ray to near infra-red
- (2012) Ron J. Pace et al. DALTON TRANSACTIONS
- Site-Selective X-ray Spectroscopy on an Asymmetric Model Complex of the [FeFe] Hydrogenase Active Site
- (2012) Nils Leidel et al. INORGANIC CHEMISTRY
- Electronic Structures of the [V(tbpy)3]z (z = 3+, 2+, 0, 1−) Electron Transfer Series
- (2012) Amanda C. Bowman et al. INORGANIC CHEMISTRY
- Full geometry optimizations of the mixed-valence CaMn4O4X(H2O)4(X=OH or O) cluster in OEC of PS II: Degree of symmetry breaking of the labile Mn-X-Mn bond revealed by several hybrid DFT calculations
- (2012) K. Yamaguchi et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- Theoretical EXAFS studies of a model of the oxygen-evolving complex of photosystem II obtained with the quantum cluster approach
- (2012) Xichen Li et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- The nature of chemical bonds of the CaMn4O5cluster in oxygen evolving complex of photosystem II: Jahn-Teller distortion and its suppression by Ca doping in cubane structures
- (2012) K. Yamaguchi et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- Modeling Near-Edge Fine Structure X-ray Spectra of the Manganese Catalytic Site for Water Oxidation in Photosystem II
- (2012) Barbara Brena et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Oxygen-Evolving Mn Cluster in Photosystem II: The Protonation Pattern and Oxidation State in the High-Resolution Crystal Structure
- (2012) Artur Galstyan et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- 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
- (2012) Leonid Rapatskiy et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Modelling the metal atom positions of the Photosystem II water oxidising complex: a density functional theory appraisal of the 1.9 Å resolution crystal structure
- (2012) Simon Petrie et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Mechanisms for proton release during water oxidation in the S2 to S3 and S3 to S4 transitions in photosystem II
- (2012) Per E. M. Siegbahn PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Alternating electron and proton transfer steps in photosynthetic water oxidation
- (2012) A. Klauss et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Structural–Functional Role of Chloride in Photosystem II
- (2011) Ivan Rivalta et al. BIOCHEMISTRY
- S1-State Model of the O2-Evolving Complex of Photosystem II
- (2011) Sandra Luber et al. BIOCHEMISTRY
- The electronic structures of the S2 states of the oxygen-evolving complexes of photosystem II in plants and cyanobacteria in the presence and absence of methanol
- (2011) Ji-Hu Su et al. BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- Structural models of the manganese complex of photosystem II and mechanistic implications
- (2011) Alexander Grundmeier et al. BIOCHIMICA ET BIOPHYSICA ACTA-BIOENERGETICS
- Labile electronic and spin states of the CaMn4O5 cluster in the PSII system refined to the 1.9 Å X-ray resolution. UB3LYP computational results
- (2011) Keita Kanda et al. CHEMICAL PHYSICS LETTERS
- Toward the Assignment of the Manganese Oxidation Pattern in the Water-Oxidizing Complex of Photosystem II: A Time-Dependent DFT Study of XANES Energies
- (2011) Adrian R. Jaszewski et al. CHEMISTRY-A EUROPEAN JOURNAL
- Computation of Hyperfine Tensors for Dinuclear MnIIIMnIV Complexes by Broken-Symmetry Approaches: Anisotropy Transfer Induced by Local Zero-Field Splitting
- (2011) Johannes Schraut et al. CHEMPHYSCHEM
- The Effect of Backbone Constraints: The Case of Water Oxidation by the Oxygen-Evolving Complex in PSII
- (2011) Per E. M. Siegbahn CHEMPHYSCHEM
- Can oxidation states and the protonation pattern of oxomanganese complexes be recognized from their structures?
- (2011) Arturo Robertazzi et al. CRYSTENGCOMM
- On the mechanism of water oxidation by a bimetallic manganese catalyst: A density functional study
- (2011) W. M. C. Sameera et al. DALTON TRANSACTIONS
- Prediction of high-valent iron K-edge absorption spectra by time-dependent Density Functional Theory
- (2011) P. Chandrasekaran et al. DALTON TRANSACTIONS
- Wateroxidation catalysed by manganese compounds: from complexes to ‘biomimetic rocks’
- (2011) Mathias Wiechen et al. DALTON TRANSACTIONS
- Synthetic manganese–calcium oxides mimic the water-oxidizing complex of photosynthesis functionally and structurally
- (2011) Ivelina Zaharieva et al. Energy & Environmental Science
- Electronic Structure of a Weakly Antiferromagnetically Coupled MnIIMnIIIModel Relevant to Manganese Proteins: A Combined EPR,55Mn-ENDOR, and DFT Study
- (2011) Nicholas Cox et al. INORGANIC CHEMISTRY
- Manganese K-Edge X-Ray Absorption Spectroscopy as a Probe of the Metal–Ligand Interactions in Coordination Compounds
- (2011) Michael Roemelt et al. INORGANIC CHEMISTRY
- Structure and reactivity of the mixed-valence CaMn4O5(H2O)4 and CaMn4O4(OH)(H2O)4 clusters at oxygen evolution complex of photosystem II. Hybrid DFT (UB3LYP and UBHandHLYP) calculations
- (2011) S. Yamanaka et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- Possible mechanisms of water splitting reaction based on proton and electron release pathways revealed for CaMn4O5 cluster of PSII refined to 1.9 Å X-ray resolution
- (2011) T. Saito et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- A tunable general purpose Q-band resonator for CW and pulse EPR/ENDOR experiments with large sample access and optical excitation
- (2011) Edward Reijerse et al. JOURNAL OF MAGNETIC RESONANCE
- S1-state Mn4Ca complex of Photosystem II exists in equilibrium between the two most-stable isomeric substates: XRD and EXAFS evidence
- (2011) Masami Kusunoki JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY B-BIOLOGY
- Recent theoretical studies of water oxidation in photosystem II
- (2011) Per E.M. Siegbahn JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY B-BIOLOGY
- Structural and Electronic Models of the Water Oxidizing Complex in the S0State of Photosystem II: A Density Functional Study.
- (2011) Adrian R. Jaszewski et al. JOURNAL OF PHYSICAL CHEMISTRY B
- X-ray Absorption Spectroscopic and Computational Investigation of a Possible S···S Interaction in the [Cu3S2]3+Core
- (2011) Ritimukta Sarangi et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- 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 S2State
- (2011) Nicholas Cox et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Theoretical Evaluation of Structural Models of the S2State in the Oxygen Evolving Complex of Photosystem II: Protonation States and Magnetic Interactions
- (2011) William Ames et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Crystal structure of oxygen-evolving photosystem II at a resolution of 1.9 Å
- (2011) Yasufumi Umena et al. NATURE
- Orientations of Carboxylate Groups Coupled to the Mn Cluster in the Photosynthetic Oxygen-Evolving Center As Studied by Polarized ATR-FTIR Spectroscopy
- (2010) Mitsuhiro Iizasa et al. BIOCHEMISTRY
- Solar Energy Supply and Storage for the Legacy and Nonlegacy Worlds
- (2010) Timothy R. Cook et al. CHEMICAL REVIEWS
- Density Functional Calculations of 55Mn, 14N and 13C Electron Paramagnetic Resonance Parameters Support an Energetically Feasible Model System for the S2 State of the Oxygen-Evolving Complex of Photosystem II
- (2010) Sandra Schinzel et al. CHEMISTRY-A EUROPEAN JOURNAL
- Theoretical magnetochemistry of dinuclear manganese complexes: broken symmetry density functional theory investigation on the influence of bridging motifs on structure and magnetism
- (2010) Dimitrios A. Pantazis et al. DALTON TRANSACTIONS
- A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
- (2010) Stefan Grimme et al. JOURNAL OF CHEMICAL PHYSICS
- Structures and Energetics for O2Formation in Photosystem II
- (2009) Per E. M. Siegbahn ACCOUNTS OF CHEMICAL RESEARCH
- Validation of broken-symmetry density functional methods for the calculation of electron paramagnetic resonance parameters of dinuclear mixed-valence MnIVMnIII complexes
- (2009) Sandra Schinzel et al. CANADIAN JOURNAL OF CHEMISTRY
- 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
- (2009) Dimitrios A. Pantazis et al. CHEMISTRY-A EUROPEAN JOURNAL
- Trinuclear Terpyridine Frustrated Spin System with a MnIV3O4Core: Synthesis, Physical Characterization, and Quantum Chemical Modeling of Its Magnetic Properties
- (2009) Carole Baffert et al. INORGANIC CHEMISTRY
- Magnetic and Spectroscopic Properties of Mixed Valence Manganese(III,IV) Dimers: A Systematic Study Using Broken Symmetry Density Functional Theory
- (2009) Maylis Orio et al. INORGANIC CHEMISTRY
- Complete EPR Spectrum of the S3-State of the Oxygen-Evolving Photosystem II
- (2009) Alain Boussac et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- On-line mass spectrometry: membrane inlet sampling
- (2009) Katrin Beckmann et al. PHOTOSYNTHESIS RESEARCH
- Structure of the oxygen-evolving complex of photosystem II: information on the S2 state through quantum chemical calculation of its magnetic properties
- (2009) Dimitrios A. Pantazis et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Monitoring Water Reactions during the S-State Cycle of the Photosynthetic Water-Oxidizing Center: Detection of the DOD Bending Vibrations by Means of Fourier Transform Infrared Spectroscopy†
- (2008) Hiroyuki Suzuki et al. BIOCHEMISTRY
- Efficient, approximate and parallel Hartree–Fock and hybrid DFT calculations. A ‘chain-of-spheres’ algorithm for the Hartree–Fock exchange
- (2008) Frank Neese et al. CHEMICAL PHYSICS
- Structural, Magnetic Coupling and Oxidation State Trends in Models of the CaMn4 Cluster in Photosystem II
- (2008) Simon Petrie et al. CHEMISTRY-A EUROPEAN JOURNAL
- A Structure-Consistent Mechanism for Dioxygen Formation in Photosystem II
- (2008) Per E. M. Siegbahn CHEMISTRY-A EUROPEAN JOURNAL
- Solar water-splitting into H2 and O2: design principles of photosystem II and hydrogenases
- (2008) Wolfgang Lubitz et al. Energy & Environmental Science
- All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms
- (2008) Dimitrios A. Pantazis et al. Journal of Chemical Theory and Computation
- Prediction of Iron K-Edge Absorption Spectra Using Time-Dependent Density Functional Theory†
- (2008) Serena DeBeer George et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Quantum Mechanics/Molecular Mechanics Study of the Catalytic Cycle of Water Splitting in Photosystem II
- (2008) Eduardo M. Sproviero et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- A Model of the Oxygen-Evolving Center of Photosystem II Predicted by Structural Refinement Based on EXAFS Simulations
- (2008) Eduardo M. Sproviero et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Effects of methanol on the S i -state transitions in photosynthetic water-splitting
- (2008) Birgit Nöring et al. PHOTOSYNTHESIS RESEARCH
- Structural changes in the Mn4Ca cluster and the mechanism of photosynthetic water splitting
- (2008) Y. Pushkar et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- 18O-Water exchange in photosystem II: Substrate binding and intermediates of the water splitting cycle
- (2007) W HILLIER et al. COORDINATION CHEMISTRY REVIEWS
- Protein ligation of the photosynthetic oxygen-evolving center
- (2007) R DEBUS COORDINATION CHEMISTRY REVIEWS
- Photoassembly of the water-oxidizing complex in photosystem II
- (2007) J DASGUPTA et al. COORDINATION CHEMISTRY REVIEWS
- Computational studies of the O2-evolving complex of photosystem II and biomimetic oxomanganese complexes
- (2007) E SPROVIERO et al. COORDINATION CHEMISTRY REVIEWS
- The manganese complex of photosystem II in its reaction cycle—Basic framework and possible realization at the atomic level
- (2007) H DAU et al. COORDINATION CHEMISTRY REVIEWS
- Mixed valency in polynuclear MnII/MnIII, MnIII/MnIV and MnII/MnIII/MnIV clusters: a foundation for high-spin molecules and single-molecule magnets
- (2007) T. C Stamatatos et al. PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
- Mechanism and energy diagram for O-O bond formation in the oxygen-evolving complex in photosystem II
- (2007) P. E.M Siegbahn PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY B-BIOLOGICAL SCIENCES
- On the structure of the manganese complex of photosystem II: extended-range EXAFS data and specific atomic-resolution models for four S-states
- (2007) H. Dau et al. PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY B-BIOLOGICAL SCIENCES
- FTIR detection of water reactions in the oxygen-evolving centre of photosystem II
- (2007) T. Noguchi PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY B-BIOLOGICAL SCIENCES
Discover Peeref hubs
Discuss science. Find collaborators. Network.
Join a conversationPublish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn More