[Computer modeling of interaction of calix[4]arene C-99 with subfragment-1 of myometrium myosin].
In this work the computer design of interaction of calix[4]aren C-99 with a substrate-binding center of a functionally active area of a subfragment-1 myosin of the myometrium is carried out. It is shown when using methodology of molecular docking the receipt of ligand-receptor complexes which have geometry concerted with experimental data is possible. The cross-coupling of ATP and calix[4]aren C-99 on their orientation in ligand-binding center of subfragment-1 myosin of myometrium has been studied.
Bevza
O V
OV
Bevza
A A
AA
Labyntseva
R D
RD
Cherenok
S O
SO
Kal'chenko
V I
VI
Kosterin
S O
SO
D000255:Adenosine Triphosphate / Q000737:chemistry; D000818:Animals; D047250:Calixarenes / Q000737:chemistry*; D003198:Computer Simulation; D005260:Female; D008024:Ligands; D008956:Models, Chemical; D008958:Models, Molecular; D009215:Myometrium / Q000378:metabolism*; D015879:Myosin Subfragments / Q000737:chemistry* / Q000378:metabolism; D011485:Protein Binding; D011487:Protein Conformation; D055672:Static Electricity; D013379:Substrate Specificity
D008024:Ligands; D015879:Myosin Subfragments; C552062:calix(4)arene C-99; D047250:Calixarenes; D000255:Adenosine Triphosphate