Differences and Comparisons of the Properties and Reactivities of Iron(III)-hydroperoxo Complexes with Saturated Coordination Sphere

Comparison of the Reactivity of Nonheme Iron(IV)-Oxo versus Iron(IV)-Imido Complexes: Which is the Better Oxidant?

(2013) Anil Kumar Vardhaman et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Mechanistic Implications of Persulfenate and Persulfide Binding in the Active Site of Cysteine Dioxygenase

(2013) Richard J. Souness et al.   BIOCHEMISTRY

Mechanistic insight into halide oxidation by non-heme iron complexes. Haloperoxidase versus halogenase activity

(2013) Anil Kumar Vardhaman et al.   CHEMICAL COMMUNICATIONS

Computational modelling of oxygenation processes in enzymes and biomimetic model complexes

(2013) Sam P. de Visser et al.   CHEMICAL COMMUNICATIONS

Quantum Mechanics/Molecular Mechanics Study on the Oxygen Binding and Substrate Hydroxylation Step in AlkB Repair Enzymes

(2013) Matthew G. Quesne et al.   CHEMISTRY-A EUROPEAN JOURNAL

Generation of a High-Valent Iron Imido Corrolazine Complex and NR Group Transfer Reactivity

(2013) Pannee Leeladee et al.   INORGANIC CHEMISTRY

Comparison of High-Spin and Low-Spin Nonheme FeIII–OOH Complexes in O–O Bond Homolysis and H-Atom Abstraction Reactivities

(2013) Lei V. Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanistic Insights on the ortho-Hydroxylation of Aromatic Compounds by Non-heme Iron Complex: A Computational Case Study on the Comparative Oxidative Ability of Ferric-Hydroperoxo and High-Valent FeIV═O and FeV═O Intermediates

(2013) Azaj Ansari et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A Mononuclear Non-Heme High-Spin Iron(III)–Hydroperoxo Complex as an Active Oxidant in Sulfoxidation Reactions

(2013) Yun Mi Kim et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Conversion of high-spin iron(iii)–alkylperoxo to iron(iv)–oxo species via O–O bond homolysis in nonheme iron models

(2013) Seungwoo Hong et al.   Chemical Science

Hydroxylation of Aromatics with the Help of a Non-Haem FeOOH: A Mechanistic Study under Single-Turnover and Catalytic Conditions

(2012) Aurore Thibon et al.   CHEMISTRY-A EUROPEAN JOURNAL

Resonance Raman characterization of mononuclear heme-peroxo intermediate models

(2012) Takehiro Ohta et al.   COORDINATION CHEMISTRY REVIEWS

Structure and function of atypically coordinated enzymatic mononuclear non-heme-Fe(II) centers

(2012) Daniela Buongiorno et al.   COORDINATION CHEMISTRY REVIEWS

Nonheme oxoiron(iv) complexes of pentadentate N5 ligands: spectroscopy, electrochemistry, and oxidative reactivity

(2012) Dong Wang et al.   Chemical Science

Nonheme ferric hydroperoxo intermediates are efficient oxidants of bromide oxidation

(2011) Anil Kumar Vardhaman et al.   CHEMICAL COMMUNICATIONS

Cytochromes P450 as useful biocatalysts: addressing the limitations

(2011) Elaine O'Reilly et al.   CHEMICAL COMMUNICATIONS

Investigation of the Mechanism of Formation of a Thiolate-Ligated Fe(III)-OOH

(2011) Elaine Nam et al.   INORGANIC CHEMISTRY

Axial Ligand Effect On The Rate Constant of Aromatic Hydroxylation By Iron(IV)–Oxo Complexes Mimicking Cytochrome P450 Enzymes

(2011) Devesh Kumar et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A Biomimetic Ferric Hydroperoxo Porphyrin Intermediate

(2010) Sam P. de Visser et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Molecular probes of the mechanism of cytochrome P450. Oxygen traps a substrate radical intermediate

(2010) Harriet L.R. Cooper et al.   ARCHIVES OF BIOCHEMISTRY AND BIOPHYSICS

Anilinic N-Oxides Support Cytochrome P450-Mediated N-Dealkylation through Hydrogen-Atom Transfer

(2010) Kenneth M. Roberts et al.   CHEMISTRY-A EUROPEAN JOURNAL

The Axial Ligand Effect on Aliphatic and Aromatic Hydroxylation by Non-heme Iron(IV)-oxo Biomimetic Complexes

(2010) Sam P. de Visser et al.   Chemistry-An Asian Journal

Cytochromes P450: exploiting diversity and enabling application as biocatalysts

(2010) Gideon Grogan   CURRENT OPINION IN CHEMICAL BIOLOGY

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

Steric Factors Override Thermodynamic Driving Force in Regioselectivity of Proline Hydroxylation by Prolyl-4-hydroxylase Enzymes

(2010) Baharan Karamzadeh et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Oxoferryl Porphyrin/Hydrogen Peroxide System Whose Behavior is Equivalent to Hydroperoxoferric Porphyrin

(2010) Hiroaki Kitagishi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Definition of the intermediates and mechanism of the anticancer drug bleomycin using nuclear resonance vibrational spectroscopy and related methods

(2010) L. V. Liu et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Cytochrome P450 Compound I: Capture, Characterization, and C-H Bond Activation Kinetics

(2010) J. Rittle et al.   SCIENCE

A Non-Heme Iron-Mediated Chemical Demethylation in DNA and RNA

(2009) Chengqi Yi et al.   ACCOUNTS OF CHEMICAL RESEARCH

Spectroscopic Characterization of a Hydroperoxo–Heme Intermediate: Conversion of a Side-On Peroxo to an End-On Hydroperoxo Complex

(2009) Jin-Gang Liu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Hydrocarbon Hydroxylation by Cytochrome P450 Enzymes

(2009) Paul R. Ortiz de Montellano   CHEMICAL REVIEWS

Direct Comparison of the Reactivity of Model Complexes for Compounds 0, I, and II in Oxygenation, Hydrogen-Abstraction, and Hydride-Transfer Processes

(2009) Christoph Fertinger et al.   CHEMISTRY-A EUROPEAN JOURNAL

How Does the Axial Ligand of Cytochrome P450 Biomimetics Influence the Regioselectivity of Aliphatic versus Aromatic Hydroxylation?

(2009) Sam P. de Visser et al.   CHEMISTRY-A EUROPEAN JOURNAL

Factors That Affect the Nature of the Final Oxidation Products in “Peroxo-Shunt” Reactions of Iron-Porphyrin Complexes

(2009) Alicja Franke et al.   CHEMISTRY-A EUROPEAN JOURNAL

We two alone will sing: the two-substrate α-keto acid-dependent oxygenases

(2009) Panqing He et al.   CURRENT OPINION IN CHEMICAL BIOLOGY

Mononuclear iron complexes relevant to nonheme iron oxygenases. Synthesis, characterizations and reactivity of Fe-Oxo and Fe-Peroxo intermediates

(2009) Aurore Thibon et al.   DALTON TRANSACTIONS

Reactivities of Fe(IV) Complexes with Oxo, Hydroxo, and Alkylperoxo Ligands: An Experimental and Computational Study

(2009) Adam T. Fiedler et al.   INORGANIC CHEMISTRY

Density Functional Theory Applied to a Difference in Pathways Taken by the Enzymes Cytochrome P450 and Superoxide Reductase: Spin States of Ferric Hydroperoxo Intermediates and Hydrogen Bonds from Water

(2009) Panida Surawatanawong et al.   INORGANIC CHEMISTRY

How is the Reactivity of Cytochrome P450cam Affected by Thr252X Mutation? A QM/MM Study for X = Serine, Valine, Alanine, Glycine

(2009) Muhannad Altarsha et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Trends in Substrate Hydroxylation Reactions by Heme and Nonheme Iron(IV)-Oxo Oxidants Give Correlations between Intrinsic Properties of the Oxidant with Barrier Height

(2009) Sam P. de Visser   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mononuclear non-heme iron enzymes with the 2-His-1-carboxylate facial triad: recent developments in enzymology and modeling studies

(2008) Pieter C. A. Bruijnincx et al.   CHEMICAL SOCIETY REVIEWS

Preparation and Characterization of a Microcrystalline Non-Heme FeIII(OOH) Complex Powder: EPR Reinvestigation of FeIII(OOH) Complexes—Improvement of the Perturbation Equations for theg Tensor of Low-Spin FeIII

(2008) Marlène Martinho et al.   CHEMISTRY-A EUROPEAN JOURNAL

Elucidating enzyme mechanism and intrinsic chemical properties of short-lived intermediates in the catalytic cycles of cysteine dioxygenase and taurine/α-ketoglutarate dioxygenase

(2008) Sam P. de Visser   COORDINATION CHEMISTRY REVIEWS

FeII/α-ketoglutarate hydroxylases involved in nucleobase, nucleoside, nucleotide, and chromatin metabolism

(2008) Jana M. Simmons et al.   DALTON TRANSACTIONS

Nuclear Quantum Tunneling in the Light-activated Enzyme Protochlorophyllide Oxidoreductase

(2008) Derren J. Heyes et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Non-heme iron polyazadentate complexes as catalysts for aromatic hydroxylation by H2O2: Particular efficiency of tetrakis(2-pyridylmethyl)ethylenediamine–iron(II) complexes

(2008) Aurore Thibon et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Resonance Raman Characterization of the Peroxo and Hydroperoxo Intermediates in Cytochrome P450†

(2008) Ilia G. Denisov et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Rational Tuning of the Thiolate Donor in Model Complexes of Superoxide Reductase: Direct Evidence for atransInfluence in FeIII−OOR Complexes

(2008) Frances Namuswe et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A Valence Bond Modeling of Trends in Hydrogen Abstraction Barriers and Transition States of Hydroxylation Reactions Catalyzed by Cytochrome P450 Enzymes

(2008) Sason Shaik et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Versatility of biological non-heme Fe(II) centers in oxygen activation reactions

(2008) Elena G Kovaleva et al.   Nature Chemical Biology

The Mechanism for Isopenicillin N Synthase from Density-Functional Modeling Highlights the Similarities with Other Enzymes in the 2-His-1-carboxylate Family†

(2007) Marcus Lundberg et al.   BIOCHEMISTRY