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TitleIdentification of potent inhibitors of the sortilin-progranulin interaction.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 30, Page 127403-127403, Year 2020
Publish dateMay 21, 2020 (structure data deposition date)
AuthorsStachel, S.J. / Ginnetti, A.T. / Johnson, S.A. / Cramer, P. / Wang, Y. / Bukhtiyarova, M. / Krosky, D. / Stump, C. / Hurzy, D.M. / Schlegel, K.A. ...Stachel, S.J. / Ginnetti, A.T. / Johnson, S.A. / Cramer, P. / Wang, Y. / Bukhtiyarova, M. / Krosky, D. / Stump, C. / Hurzy, D.M. / Schlegel, K.A. / Cooke, A.J. / Allen, S. / O'Donnell, G. / Ziebell, M. / Parthasarathy, G. / Getty, K.L. / Ho, T. / Ou, Y. / Jovanovska, A. / Carroll, S.S. / Pausch, M. / Lumb, K. / Mosser, S.D. / Voleti, B. / Klein, D.J. / Soisson, S.M. / Zerbinatti, C. / Coleman, P.J.
External linksBioorg. Med. Chem. Lett. / PubMed:32738972
MethodsX-ray diffraction
Resolution2.7 - 2.9 Å
Structure data

PDB-6x3l:
Sortilin-Progranulin Interaction With Compound 2
Method: X-RAY DIFFRACTION / Resolution: 2.7 Å

PDB-6x48:
Sortilin-Progranulin Interaction With Compound 17
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

PDB-6x4h:
Sortilin-Progranulin Interaction With Compound 24
Method: X-RAY DIFFRACTION / Resolution: 2.9 Å

Chemicals

ChemComp-UMJ:
1-benzyl-3-tert-butyl-1H-pyrazole-5-carboxylic acid

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-UP4:
N-(3,5-dichlorobenzene-1-carbonyl)-5,5-dimethyl-L-norleucine


ChemComp, No image

ChemComp-UNL:
Unknown ligand

ChemComp-UOY:
4-methyl-N-(6-phenoxypyridine-3-carbonyl)-L-leucine

Source
  • homo sapiens (human)
KeywordsUNKNOWN FUNCTION / Protein Protein Interaction

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