Theoretical investigation of substrate specificity for cytochromes P450 IA2, P450 IID6 and P450 IIIA4 (Q59614218)

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4 November 2019

title

Theoretical investigation of substrate specificity for cytochromes P450 IA2, P450 IID6 and P450 IIIA4 (English)

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4 November 2019

2

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4 November 2019

Maria Cristina Menziani

series ordinal

3

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4 November 2019

author name string

F De Rienzo

series ordinal

1

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4 November 2019

P G De Benedetti

series ordinal

4

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4 November 2019

publication date

1 January 2000

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Journal of Computer - Aided Molecular Design

4 November 2019

published in

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4 November 2019

volume

14

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4 November 2019

issue

1

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4 November 2019

page(s)

93-116

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The role of Thr268 in oxygen activation of cytochrome P450BM-3

4 November 2019

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Molecular modelling of CYP2E1 enzymes from rat, mouse and man: an explanation for species differences in butadiene metabolism and potential carcinogenicity, and rationalization of CYP2E substrate specificity

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Differential roles of Glu318 and Thr319 in cytochrome P450 1A2 catalysis supported by NADPH-cytochrome P450 reductase and tert-butyl hydroperoxide

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Substrate recognition sites in cytochrome P450 family 2 (CYP2) proteins inferred from comparative analyses of amino acid and coding nucleotide sequences

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Use of homology modeling in conjunction with site-directed mutagenesis for analysis of structure-function relationships of mammalian cytochromes P450.

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Modeling the active sites of cytochrome P450s and glutathione S-transferases, two of the most important biotransformation enzymes

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Substrate specificity of human liver cytochrome P-450 debrisoquine 4-hydroxylase probed using immunochemical inhibition and chemical modeling

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Identification and location of alpha-helices in mammalian cytochromes P450

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1-Methyl-4-phenyl-1,2,3,6-tetrahydropyridine as a Substrate of Cytochrome P450 2D6: Allosteric Effects of NADPH−Cytochrome P450 Reductase†

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Molecular modelling of human CYP2C subfamily enzymes CYP2C9 and CYP2C19: rationalization of substrate specificity and site-directed mutagenesis experiments in the CYP2C subfamily

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Structure of cytochrome P450eryF involved in erythromycin biosynthesis

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Molecular modelling of mammalian CYP2B isoforms and their interaction with substrates, inhibitors and redox partners

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Determinants of the substrate specificity of human cytochrome P-450 CYP2D6: design and construction of a mutant with testosterone hydroxylase activity

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Characterization of human cytochrome P450 enzymes

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Essential role of His163 of cytochrome P450 1A2 in catalytic functions associated with cytochrome b5

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Crystal structures of cytochrome P-450CAM complexed with camphane, thiocamphor, and adamantane: factors controlling P-450 substrate hydroxylation

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Crystal structure of substrate-free Pseudomonas putida cytochrome P-450

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A role for Asp-251 in cytochrome P-450cam oxygen activation

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12 December 2020

Molecular modeling of cytochrome P450 3A4

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12 December 2020

Speculations on the substrate structure-activity relationship (SSAR) of cytochrome P450 enzymes

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12 December 2020

Three-dimensional modelling of human cytochrome P450 1A2 and its interaction with caffeine and MeIQ.

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Crystal structure of hemoprotein domain of P450BM-3, a prototype for microsomal P450's

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A combination of mutations in the CYP2D6*17 (CYP2D6Z) allele causes alterations in enzyme function.

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Molecular modeling of cytochrome P450 2B1: mode of membrane insertion and substrate specificity

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Effect of mutations at Lys250, Arg251, and Lys253 of cytochrome P450 1A2 on the catalytic activities and the bindings of bifunctional axial ligands.

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Molecular modelling of CYP3A4 from an alignment with CYP102: identification of key interactions between putative active site residues and CYP3A-specific chemicals

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Critical amino-terminal segments in insertion of rat liver cytochrome P450 3A1 into the endoplasmic reticulum membrane

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12 December 2020

Expression of truncated forms of liver microsomal P450 cytochromes 2B4 and 2E1 in Escherichia coli: influence of NH2-terminal region on localization in cytosol and membranes

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A model for human cytochrome P450 2D6 based on homology modeling and NMR studies of substrate binding

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12 December 2020

Membrane topology of liver microsomal cytochrome P450 2B4 determined via monoclonal antibodies directed to the halt-transfer signal

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12 December 2020

Analysis of four residues within substrate recognition site 4 of human cytochrome P450 3A4: role in steroid hydroxylase activity and alpha-naphthoflavone stimulation.

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12 December 2020

Identification of three key residues in substrate recognition site 5 of human cytochrome P450 3A4 by cassette and site-directed mutagenesis.

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12 December 2020

Molecular modelling of CYP1A subfamily members based on an alignment with CYP102: rationalization of CYP1A substrate specificity in terms of active site amino acid residues

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12 December 2020

Combining evolutionary information and neural networks to predict protein secondary structure

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12 December 2020

Effect of mutations of ionic amino acids of cytochrome P450 1A2 on catalytic activities toward 7-ethoxycoumarin and methanol

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12 December 2020

Comparative protein modelling by satisfaction of spatial restraints

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12 December 2020