Peripheral heme substituents control the hydrogen-atom abstraction chemistry in cytochromes P450.
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Crystal structure of the human prostacyclin synthaseStructural basis for androgen specificity and oestrogen synthesis in human aromataseCrystal structures of Trypanosoma brucei sterol 14alpha-demethylase and implications for selective treatment of human infectionsIntegrated Modeling Program, Applied Chemical Theory (IMPACT)Factors influencing the energetics of electron and proton transfers in proteins. What can be learned from calculations.A high-throughput screen for porphyrin metal chelatases: application to the directed evolution of ferrochelatases for metalloporphyrin biosynthesis.The structure of coral allene oxide synthase reveals a catalase adapted for metabolism of a fatty acid hydroperoxide.X-ray absorption spectroscopy of chloroperoxidase compound I: Insight into the reactive intermediate of P450 chemistryHeme enzyme structure and function.Molecular probes of the mechanism of cytochrome P450. Oxygen traps a substrate radical intermediateDynamics of CYP51: implications for function and inhibitor design.Modeling heme proteins using atomistic simulations.Intermediates in dioxygen activation by methane monooxygenase: a QM/MM study.QM/MM study of the active species of the human cytochrome P450 3A4, and the influence thereof of the multiple substrate binding.Recent Progress in the Discovery of Next Generation Inhibitors of Aromatase from the Structure-Function Perspective.Selective functionalisation of saturated C-H bonds with metalloporphyrin catalysts.A practical guide to modelling enzyme-catalysed reactions.Use of density functional theory in drug metabolism studies.Molecular docking and 3D-QSAR-based virtual screening of flavonoids as potential aromatase inhibitors against estrogen-dependent breast cancer.Comprehensive and Automated Linear Interaction Energy Based Binding-Affinity Prediction for Multifarious Cytochrome P450 Aromatase InhibitorsSuccessful application of the DBLOC method to the hydroxylation of camphor by cytochrome p450.QM/MM Simulation on P450 BM3 Enzyme Catalysis Mechanism.Mapping protein electron transfer pathways with QM/MM methods.Electrostatic environment of hemes in proteins: pK(a)s of hydroxyl ligandsAnalysis of polarization in QM/MM modelling of biologically relevant hydrogen bonds.The effect of heme environment on the hydrogen abstraction reaction of camphor in P450cam catalysis: a QM/MM study.Tyrosine radical formation in the reaction of wild type and mutant cytochrome P450cam with peroxy acids: a multifrequency EPR study of intermediates on the millisecond time scale.Catalytic diversity and homotropic allostery of two Cytochrome P450 monooxygenase like proteins from Trichoderma brevicompactum.DOX: A new computational protocol for accurate prediction of the protein-ligand binding structures.Water complexes of cytochrome P450: insights from energy decomposition analysis.Nonfitting protein-ligand interaction scoring function based on first-principles theoretical chemistry methods: development and application on kinase inhibitors.Cytochrome P450 Monooxygenase-Catalyzed Ring Opening of the Bicyclic Amine, Nortropine: An Experimental and DFT Computational StudyAccurate Description of Spin States and its Implications for CatalysisMolecular Determinants of Substrate Affinity and Enzyme Activity of a Cytochrome P450 VariantQM/MM-Methoden für biomolekulare SystemeWhat can molecular modelling bring to the design of artificial inorganic cofactors?
P2860
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P2860
Peripheral heme substituents control the hydrogen-atom abstraction chemistry in cytochromes P450.
description
2003 nî lūn-bûn
@nan
2003 թուականի Մայիսին հրատարակուած գիտական յօդուած
@hyw
2003 թվականի մայիսին հրատարակված գիտական հոդված
@hy
2003年の論文
@ja
2003年論文
@yue
2003年論文
@zh-hant
2003年論文
@zh-hk
2003年論文
@zh-mo
2003年論文
@zh-tw
2003年论文
@wuu
name
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@ast
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@en
type
label
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@ast
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@en
prefLabel
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@ast
Peripheral heme substituents c ...... chemistry in cytochromes P450.
@en
P2860
P356
P1476
Peripheral heme substituents c ...... chemistry in cytochromes P450
@en
P2093
Richard A Friesner
Stephen J Lippard
P2860
P304
P356
10.1073/PNAS.0732000100
P407
P577
2003-05-27T00:00:00Z