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Title | Scaffold-hopping from xanthines to tricyclic guanines: A case study of dipeptidyl peptidase 4 (DPP4) inhibitors. |
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Journal, issue, pages | Bioorg. Med. Chem., Vol. 24, Page 5534-5545, Year 2016 |
Publish date | Aug 29, 2016 (structure data deposition date) |
![]() | Pissarnitski, D.A. / Zhao, Z. / Cole, D. / Wu, W.L. / Domalski, M. / Clader, J.W. / Scapin, G. / Voigt, J. / Soriano, A. / Kelly, T. ...Pissarnitski, D.A. / Zhao, Z. / Cole, D. / Wu, W.L. / Domalski, M. / Clader, J.W. / Scapin, G. / Voigt, J. / Soriano, A. / Kelly, T. / Powles, M.A. / Yao, Z. / Burnett, D.A. |
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Methods | X-ray diffraction |
Resolution | 1.76 - 2.61 Å |
Structure data | ![]() PDB-5t4b: ![]() PDB-5t4e: ![]() PDB-5t4f: ![]() PDB-5t4h: |
Chemicals | ![]() ChemComp-NAG: ![]() ChemComp-75N: ![]() ChemComp-NA: ![]() ChemComp-HOH: ![]() ChemComp-75L: ![]() ChemComp-75M: ![]() ChemComp-75J: |
Source |
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![]() | Hydrolase/Hydrolase Inhibitor / Structure-based drug design / diabetes / DPP4 inhibitors / hydrolase / Hydrolase-Hydrolase Inhibitor complex |