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Title | 3'-Axial CH(2) OH Substitution on Glucopyranose does not Increase Glycogen Phosphorylase Inhibitory Potency. QM/MM-PBSA Calculations Suggest Why. |
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Journal, issue, pages | Chem. Biol. Drug Des., Vol. 79, Page 663-673, Year 2012 |
Publish date | Jul 18, 2011 (structure data deposition date) |
Authors | Manta, S. / Xipnitou, A. / Kiritsis, C. / Kantsadi, A.L. / Hayes, J.M. / Skamnaki, V.T. / Lamprakis, C. / Kontou, M. / Zoumpoulakis, P. / Zographos, S.E. ...Manta, S. / Xipnitou, A. / Kiritsis, C. / Kantsadi, A.L. / Hayes, J.M. / Skamnaki, V.T. / Lamprakis, C. / Kontou, M. / Zoumpoulakis, P. / Zographos, S.E. / Leonidas, D.D. / Komiotis, D. |
External links | Chem. Biol. Drug Des. / PubMed:22296957 |
Methods | X-ray diffraction |
Resolution | 2.4 Å |
Structure data | PDB-3sym: PDB-3syr: |
Chemicals | ChemComp-GP0: ChemComp-HOH: ChemComp-GPK: |
Source |
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Keywords | TRANSFERASE/TRANSFERASE INHIBITOR / alpha and beta protein / TRANSFERASE-TRANSFERASE INHIBITOR complex / muscle / transferase / glycogen metabolism / alpha and beta protein (a/b) |