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Structure paper

TitleAn allosteric MALT1 inhibitor is a molecular corrector rescuing function in an immunodeficient patient.
Journal, issue, pagesNat. Chem. Biol., Vol. 15, Page 304-313, Year 2019
Publish dateDec 9, 2017 (structure data deposition date)
AuthorsQuancard, J. / Klein, T. / Fung, S.Y. / Renatus, M. / Hughes, N. / Israel, L. / Priatel, J.J. / Kang, S. / Blank, M.A. / Viner, R.I. ...Quancard, J. / Klein, T. / Fung, S.Y. / Renatus, M. / Hughes, N. / Israel, L. / Priatel, J.J. / Kang, S. / Blank, M.A. / Viner, R.I. / Blank, J. / Schlapbach, A. / Erbel, P. / Kizhakkedathu, J. / Villard, F. / Hersperger, R. / Turvey, S.E. / Eder, J. / Bornancin, F. / Overall, C.M.
External linksNat. Chem. Biol. / PubMed:30692685
MethodsX-ray diffraction
Resolution2.43 - 2.65 Å
Structure data

PDB-6f7i:
human MALT1(329-728) IN COMPLEX WITH MLT-747
Method: X-RAY DIFFRACTION / Resolution: 2.43 Å

PDB-6h4a:
Human MALT1(329-728) in complex with MLT-748
Method: X-RAY DIFFRACTION / Resolution: 2.65 Å

Chemicals

ChemComp-CW5:
1-[2-chloranyl-7-[(1~{S})-1-methoxyethyl]pyrazolo[1,5-a]pyrimidin-6-yl]-3-(5-chloranyl-6-pyrrolidin-1-ylcarbonyl-pyridin-3-yl)urea

ChemComp-MG:
Unknown entry

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-FNB:
1-[2-chloranyl-7-[(1~{R},2~{R})-1,2-dimethoxypropyl]pyrazolo[1,5-a]pyrimidin-6-yl]-3-[5-chloranyl-6-(1,2,3-triazol-2-yl)pyridin-3-yl]urea

Source
  • homo sapiens (human)
KeywordsHYDROLASE / DIMER / EXOSITE BINDER

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