| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 7561331 | Biochimica et Biophysica Acta (BBA) - Proteins and Proteomics | 2011 | 10 Pages |
Abstract
⺠Methods were developed to quantify similarity in inhibitor specificity for homologs. ⺠Homology-based process was developed to predict inhibitor specificity determinants. ⺠Eighteen DHFR positions that play a role in ligand specificity were identified. ⺠For these, amino acid sequence homology correlates with ligand specificity. ⺠Three are in active site, 5 near the active site, the rest may act allosterically.
Keywords
L. majorPiritreximZD1694LY231514Drug-target interactionCB3717H. sapiensSpecificity determinantInhibitor specificityM. aviumL. caseiRaltitrexedTMQP. falciparumPYRTrimethoprimE. coliMBPTMPT. cruziEPMM. tuberculosisPTXMTXP. vivaxCYCdhfrT. bruceiT. gondiiTrimetrexateAllosteric interactiondihydrofolate reductasecycloguanilMethotrexatePemetrexedPyrimethamineTarget prediction
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
N.M. Goodey, K.G. Herbert, S.M. Hall, K.C. Bagley,