Proteins and Their Interactions With Small Molecules Studied by
Computer Simulations.

D 2002

Proteins and Their Interactions With Small Molecules Studied by Computer Simulations.

OTYEPKA, Michal, Miroslav STRNAD, Jiří DAMBORSKÝ, Zdeněk KŘÍŽ, Jaroslav KOČA et. al.

Základní údaje

Originální název

Proteins and Their Interactions With Small Molecules Studied by Computer Simulations.

Autoři

OTYEPKA, Michal (203 Česká republika, garant), Miroslav STRNAD (203 Česká republika), Jiří DAMBORSKÝ (203 Česká republika), Zdeněk KŘÍŽ (203 Česká republika) a Jaroslav KOČA (203 Česká republika)

Vydání

Praha, Materials Structures in Chemistry, Biology, Physics and Technology, od s. 45-46, 2 s. 2002

Nakladatel

1. setkani ceskych a slovenskych strukturnich biologu

Další údaje

Jazyk

angličtina

Typ výsledku

Stať ve sborníku

Obor

10610 Biophysics

Stát vydavatele

Česká republika

Utajení

není předmětem státního či obchodního tajemství

Kód RIV

RIV/00216224:14310/02:00007233

Organizační jednotka

Přírodovědecká fakulta

Klíčová slova anglicky

Computer Simulation; Protein; Ligand

Štítky

computer simulation, LIGAND, PROTEIN

Změněno: 20. 5. 2003 15:21, Mgr. Zdeněk Kříž, Ph.D.

Anotace

V originále

The presentation introduce an on-going research project focused on proteins and their interactions with small molecules. Two systems are studied by computer simulations; (1) cyclin-dependent kinase-2 (cdk2) and its inhibition by purine-like compounds, and (2) haloalkane dehalogenases. Cyclin-dependent kinases are enzymes controlling the cell division cycle. A deregulation of cdk has been proved to occur in human primary tumors and in tumor cell lines. It evoked potential application of cdk inhibitors in cancer therapy. Haloalkane dehalogenases are bacterial enzymes cleaving the carbon-halogen bond of the halogenated aliphatic compounds by a hydrolytic mechanism. These enzymes have a potential application in detoxification of subsurface pullutants and recovery of industrial side products.

Návaznosti

MSM 143100005, záměr

Název: Strukturně-funkční vztahy biomolekul a jejich role v metabolismu

Investor: Ministerstvo školství, mládeže a tělovýchovy ČR, Strukturně-funkční vztahy biomolekul a jejich role v metabolismu

Citovat

OTYEPKA, Michal, Miroslav STRNAD, Jiří DAMBORSKÝ, Zdeněk KŘÍŽ a Jaroslav KOČA. Proteins and Their Interactions With Small Molecules Studied by Computer Simulations. In Materials Structures in Chemistry, Biology, Physics and Technology. Praha: 1. setkani ceskych a slovenskych strukturnich biologu, 2002, s. 45-46.

@inproceedings{483320,
   author = {Otyepka, Michal and Strnad, Miroslav and Damborský, Jiří and Kříž, Zdeněk and Koča, Jaroslav},
   address = {Praha},
   booktitle = {Materials Structures in Chemistry, Biology, Physics and Technology},
   keywords = {Computer Simulation; Protein; Ligand},
   language = {eng},
   location = {Praha},
   pages = {45-46},
   publisher = {1. setkani ceskych a slovenskych strukturnich biologu},
   title = {Proteins and Their Interactions With Small Molecules Studied by Computer Simulations.},
   year = {2002}
}

TY  - JOUR
ID  - 483320
AU  - Otyepka, Michal - Strnad, Miroslav - Damborský, Jiří - Kříž, Zdeněk - Koča, Jaroslav
PY  - 2002
TI  - Proteins and Their Interactions With Small Molecules Studied by Computer Simulations.
PB  - 1. setkani ceskych a slovenskych strukturnich biologu
CY  - Praha
KW  - Computer Simulation
KW  - Protein
KW  - Ligand
N2  - The presentation introduce an on-going research project focused on proteins and their interactions with small molecules. Two systems are studied by computer simulations; (1) cyclin-dependent kinase-2 (cdk2) and its inhibition by purine-like compounds, and (2) haloalkane dehalogenases. Cyclin-dependent kinases are enzymes controlling the cell division cycle. A deregulation of cdk has been proved to occur in human primary tumors and in tumor cell lines. It evoked potential application of cdk inhibitors in cancer therapy. Haloalkane dehalogenases are bacterial enzymes cleaving the carbon-halogen bond of the halogenated aliphatic compounds by a hydrolytic mechanism. These enzymes have a potential application in detoxification of subsurface pullutants and recovery of industrial side products.
ER  -

OTYEPKA, Michal, Miroslav STRNAD, Jiří DAMBORSKÝ, Zdeněk KŘÍŽ a Jaroslav KOČA. Proteins and Their Interactions With Small Molecules Studied by Computer Simulations. In \textit{Materials Structures in Chemistry, Biology, Physics and Technology}. Praha: 1. setkani ceskych a slovenskych strukturnich biologu, 2002, s.~45-46.

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