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Machine translation
1. (WO2010026738) METHOD FOR PREDICTING ENZYME ACTIVITY BY COMPUTER SIMULATION
Latest bibliographic data on file with the International Bureau   

Pub. No.:    WO/2010/026738    International Application No.:    PCT/JP2009/004286
Publication Date: 11.03.2010 International Filing Date: 01.09.2009
IPC:
C12Q 1/48 (2006.01), G06F 19/16 (2011.01)
Applicants: NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY [JP/JP]; 1-1, Rokkodai-cho, Nada-ku, Kobe-shi, Hyogo 6578501 (JP) (For All Designated States Except US).
TAKAOKA, Yutaka [JP/JP]; (JP) (For US Only).
MIURA, Kenji [JP/JP]; (JP) (For US Only).
NISHIO, Hisahide [JP/JP]; (JP) (For US Only)
Inventors: TAKAOKA, Yutaka; (JP).
MIURA, Kenji; (JP).
NISHIO, Hisahide; (JP)
Agent: SHOJI, Takashi; (JP)
Priority Data:
2008-228434 05.09.2008 JP
Title (EN) METHOD FOR PREDICTING ENZYME ACTIVITY BY COMPUTER SIMULATION
(FR) PROCÉDÉ DE PRÉDICTION D'ACTIVITÉ ENZYMATIQUE PAR SIMULATION INFORMATIQUE
(JA) 酵素活性をコンピュータを用いたシミュレーションにより予測する方法
Abstract: front page image
(EN)Disclosed is a method for predicting enzyme activity based on the three-dimensional structure of proteins, even without actually measuring enzyme activity using proteins. This is accomplished by performing a docking simulation between a protein and a substrate by using a computer, and then predicting the enzyme activity of the protein by substituting the docking simulation results into equation 1 or 3.
(FR)L'invention concerne un procédé de prédiction d'activité enzymatique à partir de la structure tridimensionnelle de protéines, même sans mesure effective de cette activité au moyen de protéines. On procède en réalisant une simulation informatique d'accroche entre une protéine et un substrat, puis en prédisant l'activité enzymatique de la protéine par substitution des résultats de la simulation d'accroche dans l'équation 1 ou 3.
(JA) 本発明は、タンパク質を用いて実際に酵素活性を測定しなくても、タンパク質の立体構造に基づいて酵素活性を予測可能とすることを課題とする。かかる課題は、コンピュータによりタンパク質と基質とのドッキングシミュレーションを行い、かかるドッキングシミュレーションの結果を式1または3に代入して、タンパク質の酵素活性を予測することにより解決される。
Designated States: AE, AG, AL, AM, AO, AT, AU, AZ, BA, BB, BG, BH, BR, BW, BY, BZ, CA, CH, CL, CN, CO, CR, CU, CZ, DE, DK, DM, DO, DZ, EC, EE, EG, ES, FI, GB, GD, GE, GH, GM, GT, HN, HR, HU, ID, IL, IN, IS, JP, KE, KG, KM, KN, KP, KR, KZ, LA, LC, LK, LR, LS, LT, LU, LY, MA, MD, ME, MG, MK, MN, MW, MX, MY, MZ, NA, NG, NI, NO, NZ, OM, PE, PG, PH, PL, PT, RO, RS, RU, SC, SD, SE, SG, SK, SL, SM, ST, SV, SY, TJ, TM, TN, TR, TT, TZ, UA, UG, US, UZ, VC, VN, ZA, ZM, ZW.
African Regional Intellectual Property Organization (BW, GH, GM, KE, LS, MW, MZ, NA, SD, SL, SZ, TZ, UG, ZM, ZW)
Eurasian Patent Organization (AM, AZ, BY, KG, KZ, MD, RU, TJ, TM)
European Patent Office (AT, BE, BG, CH, CY, CZ, DE, DK, EE, ES, FI, FR, GB, GR, HR, HU, IE, IS, IT, LT, LU, LV, MC, MK, MT, NL, NO, PL, PT, RO, SE, SI, SK, SM, TR)
African Intellectual Property Organization (BF, BJ, CF, CG, CI, CM, GA, GN, GQ, GW, ML, MR, NE, SN, TD, TG).
Publication Language: Japanese (JA)
Filing Language: Japanese (JA)