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Structure paper

TitleThe dynamic conformational landscape of the protein methyltransferase SETD8.
Journal, issue, pagesElife, Vol. 8, Year 2019
Publish dateMar 5, 2017 (structure data deposition date)
AuthorsChen, S. / Wiewiora, R.P. / Meng, F. / Babault, N. / Ma, A. / Yu, W. / Qian, K. / Hu, H. / Zou, H. / Wang, J. ...Chen, S. / Wiewiora, R.P. / Meng, F. / Babault, N. / Ma, A. / Yu, W. / Qian, K. / Hu, H. / Zou, H. / Wang, J. / Fan, S. / Blum, G. / Pittella-Silva, F. / Beauchamp, K.A. / Tempel, W. / Jiang, H. / Chen, K. / Skene, R.J. / Zheng, Y.G. / Brown, P.J. / Jin, J. / Luo, C. / Chodera, J.D. / Luo, M.
External linksElife / PubMed:31081496
MethodsX-ray diffraction
Resolution2 - 2.4 Å
Structure data

PDB-5v2n:
Crystal Structure of APO Human SETD8
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-6boz:
Structure of human SETD8 in complex with covalent inhibitor MS4138
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

ChemComp-E1J:
N-(3-{[7-(2-aminoethoxy)-6-methoxy-2-(pyrrolidin-1-yl)quinazolin-4-yl]amino}propyl)prop-2-enamide

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / methyl transferase / TRANSFERASE/TRANSFERASE inhibitor / protein-small molecule inhibitor complex / TRANSFERASE-TRANSFERASE inhibitor complex

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