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-Structure paper
Title | Design of a Potent, Selective, and Brain-Penetrant Inhibitor of Wnt-Deactivating Enzyme Notum by Optimization of a Crystallographic Fragment Hit. |
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Journal, issue, pages | J. Med. Chem., Vol. 65, Page 7212-7230, Year 2022 |
Publish date | Aug 24, 2021 (structure data deposition date) |
![]() | Willis, N.J. / Mahy, W. / Sipthorp, J. / Zhao, Y. / Woodward, H.L. / Atkinson, B.N. / Bayle, E.D. / Svensson, F. / Frew, S. / Jeganathan, F. ...Willis, N.J. / Mahy, W. / Sipthorp, J. / Zhao, Y. / Woodward, H.L. / Atkinson, B.N. / Bayle, E.D. / Svensson, F. / Frew, S. / Jeganathan, F. / Monaghan, A. / Benvegnu, S. / Jolly, S. / Vecchia, L. / Ruza, R.R. / Kjaer, S. / Howell, S. / Snijders, A.P. / Bictash, M. / Salinas, P.C. / Vincent, J.P. / Jones, E.Y. / Whiting, P. / Fish, P.V. |
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Methods | X-ray diffraction |
Resolution | 1.41 - 1.68 Å |
Structure data | ![]() PDB-7pjr: ![]() PDB-7pk3: ![]() PDB-7pkv: |
Chemicals | ![]() ChemComp-NAG: ![]() ChemComp-DMS: ![]() ChemComp-7SQ: ![]() ChemComp-SO4: ![]() ChemComp-HOH: ![]() ChemComp-7T0: ![]() ChemComp-63Z: |
Source |
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![]() | SIGNALING PROTEIN / Notum Inhibitor / HYDROLASE |