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Structure paper

TitleSmall-molecule inhibition of TNF-alpha.
Journal, issue, pagesScience, Vol. 310, Page 1022-1025, Year 2005
Publish dateSep 9, 2005 (structure data deposition date)
AuthorsHe, M.M. / Smith, A.S. / Oslob, J.D. / Flanagan, W.M. / Braisted, A.C. / Whitty, A. / Cancilla, M.T. / Wang, J. / Lugovskoy, A.A. / Yoburn, J.C. ...He, M.M. / Smith, A.S. / Oslob, J.D. / Flanagan, W.M. / Braisted, A.C. / Whitty, A. / Cancilla, M.T. / Wang, J. / Lugovskoy, A.A. / Yoburn, J.C. / Fung, A.D. / Farrington, G. / Eldredge, J.K. / Day, E.S. / Cruz, L.A. / Cachero, T.G. / Miller, S.K. / Friedman, J.E. / Choong, I.C. / Cunningham, B.C.
External linksScience / PubMed:16284179
MethodsX-ray diffraction
Resolution2.1 Å
Structure data

PDB-2az5:
Crystal Structure of TNF-alpha with a small molecule inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-307:
6,7-DIMETHYL-3-[(METHYL{2-[METHYL({1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-INDOL-3-YL}METHYL)AMINO]ETHYL}AMINO)METHYL]-4H-CHROMEN-4-ONE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsCYTOKINE / TNF-alpha trimer disruption by binding of a small molecule inhibitor

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