Combined quantum mechanical and molecular mechanical simulations of one- and two-electron reduction potentials of flavin cofactor in water, medium-chain acyl-CoA dehydrogenase, and cholesterol oxidase

Combined quantum mechanical and molecular mechanical simulations of one- and two-electron reduction potentials of flavin cofactor in water, medium-chain acyl-CoA dehydrogenase, and cholesterol oxidase

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http://www.wikidata.org/entity/Q35780064
X-ray Crystallographic and Solution State Nuclear Magnetic Resonance Spectroscopic Investigations of NADP + Binding to Ferredoxin NADP Reductase from Pseudomonas aeruginosa † , ‡Calculating solution redox free energies with ab initio quantum mechanical/molecular mechanical minimum free energy path method.Computational electrochemistry: prediction of liquid-phase reduction potentials.Strictly conserved lysine of prolyl-tRNA Synthetase editing domain facilitates binding and positioning of misacylated tRNA(Pro.).Ultrafast 2D-IR spectroelectrochemistry of flavin mononucleotide.Evolutionary basis for the coupled-domain motions in Thermus thermophilus leucyl-tRNA synthetase.Interplay of flavin's redox states and protein dynamics: an insight from QM/MM simulations of dihydronicotinamide riboside quinone oxidoreductase 2.Analysis of the electrochemistry of hemes with E(m)s spanning 800 mV.Toward robust computational electrochemical predicting the environmental fate of organic pollutants.Structural basis for substrate specificity of methylsuccinyl-CoA dehydrogenase: an unusual member of the acyl-CoA dehydrogenase family.Why the Flavin Adenine Dinucleotide (FAD) Cofactor Needs To Be Covalently Linked to Complex II of the Electron-Transport Chain for the Conversion of FADH2 into FAD.Theoretical estimation of redox potential of biological quinone cofactors.Reduction potentials and acidity constants of Mn superoxide dismutase calculated by QM/MM free-energy methods.On the midpoint potential of the FAD chromophore in a BLUF-domain containing photoreceptor protein.QM/MM-Methoden für biomolekulare SystemeNew insights into the mechanism of electron transfer within flavohemoglobins: tunnelling pathways, packing density, thermodynamic and kinetic analyses
P2860

Combined quantum mechanical and molecular mechanical simulations of one- and two-electron reduction potentials of flavin cofactor in water, medium-chain acyl-CoA dehydrogenase, and cholesterol oxidase

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http://www.wikidata.org/entity/Q35780064
description
2007 nî lūn-bûn
@nan
2007年の論文
@ja
2007年論文
@yue
2007年論文
@zh-hant
2007年論文
@zh-hk
2007年論文
@zh-mo
2007年論文
@zh-tw
2007年论文
@wuu
2007年论文
@zh
2007年论文
@zh-cn
name
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@ast
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@en
type
label
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@ast
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@en
prefLabel
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@ast
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@en
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698
P932
P356
P1433
P1476
Combined quantum mechanical an ...... enase, and cholesterol oxidase
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698
P932