About: Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site

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An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

Attributes	Values
rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Cytochrome P450 2C9 (CYP2C9) is a membrane-anchored human microsomal protein involved in the drug metabolism in liver. CYP2C9 consists of an N-terminal transmembrane anchor and a catalytic cytoplasmic domain. While the structure of the catalytic domain is well-known from X-ray experiments, the complete structure and its incorporation into the membrane remains unsolved. We constructed an atomistic model of complete CYP2C9 in a dioleoylphosphatidylcholine membrane and evolved it by molecular dynamics simulations in explicit water on a 100+ ns time-scale. Cytochrome P450 2C9 (CYP2C9) is a membrane-anchored human microsomal protein involved in the drug metabolism in liver. CYP2C9 consists of an N-terminal transmembrane anchor and a catalytic cytoplasmic domain. While the structure of the catalytic domain is well-known from X-ray experiments, the complete structure and its incorporation into the membrane remains unsolved. We constructed an atomistic model of complete CYP2C9 in a dioleoylphosphatidylcholine membrane and evolved it by molecular dynamics simulations in explicit water on a 100+ ns time-scale. (en)
Title	Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site (en)
skos:prefLabel	Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site (en)
skos:notation	RIV/61989592:15310/11:33116405!RIV12-MSM-15310___
http://linked.open...avai/predkladatel	Přírodovědecká fakulta
http://linked.open...avai/riv/aktivita	P S
http://linked.open...avai/riv/aktivity	P(ED0030/01/01), P(ED2.1.00/03.0058), P(EE2.3.20.0017), P(GA303/09/1001), P(GD203/09/H046), S
http://linked.open...iv/cisloPeriodika	44
http://linked.open...vai/riv/dodaniDat	2012
http://linked.open...aciTvurceVysledku	Otyepka, Michal Hendrychová, Tereza Berka, Karel
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Univerzita Palackého v Olomouci / Přírodovědecká fakulta
http://linked.open...dnocenehoVysledku	211423
http://linked.open...ai/riv/idVysledku	RIV/61989592:15310/11:33116405
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	cytochrome P450 (en)
http://linked.open.../riv/klicoveSlovo	cytochrome P450
http://linked.open...odStatuVydavatele	US - Spojené státy americké
http://linked.open...ontrolniKodProRIV	[96C15297BA3A]
http://linked.open...i/riv/nazevZdroje	Journal of Physical Chemistry A
http://linked.open...in/vavai/riv/obor	FR
http://linked.open...ichTvurcuVysledku	3 (xsd:int)
http://linked.open...cetTvurcuVysledku	4 (xsd:int)
http://linked.open...vavai/riv/projekt	Structural Determinants of Substrate Specificity of Human Cytochromes P450 Biomedicine for regional development and human resources Regional Centre of Advanced Technologies and Materials Research team development of the Regional Centre of Advanced Technologies and Materials Biochemistry on the crossroad from in silico to in vitro
http://linked.open...UplatneniVysledku	2011
http://linked.open...v/svazekPeriodika	115
http://linked.open...iv/tvurceVysledku	Otyepka, Michal Anzenbacher, Pavel Hendrychová, Tereza Berka, Karel
http://linked.open...ain/vavai/riv/wos	000295700600015
issn	1089-5639
number of pages	8 (xsd:int)
http://bibframe.org/vocab/doi	10.1021/jp204488j
http://localhost/t...ganizacniJednotka	15310
is http://linked.open...avai/riv/vysledek of	Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site Membrane position of ibuprofen agrees with suggested access path entrance to cytochrome P450 2C9 active site

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