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Structure paper

TitleDiscovery of a selective c-MET inhibitor with a novel binding mode.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 75, Page 128948-128948, Year 2022
Publish dateAug 4, 2022 (structure data deposition date)
AuthorsCollie, G.W. / Barlind, L. / Bazzaz, S. / Borjesson, U. / Dale, I.L. / Disch, J.S. / Habeshian, S. / Jetson, R. / Khurana, P. / Madin, A. ...Collie, G.W. / Barlind, L. / Bazzaz, S. / Borjesson, U. / Dale, I.L. / Disch, J.S. / Habeshian, S. / Jetson, R. / Khurana, P. / Madin, A. / Michaelides, I.N. / Peng, L. / Snijder, A. / Stubbs, C.J.
External linksBioorg. Med. Chem. Lett. / PubMed:35987508
MethodsX-ray diffraction
Resolution2.01 - 2.394 Å
Structure data

PDB-8an8:
Crystal structure of wild-type c-MET bound by compound 7.
Method: X-RAY DIFFRACTION / Resolution: 2.394 Å

PDB-8ans:
Crystal structure of D1228V c-MET bound by compound 1.
Method: X-RAY DIFFRACTION / Resolution: 2.01 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-MDI:
3-[bis(fluoranyl)methyl]-~{N}-methyl-~{N}-[(1~{R})-8-methyl-5-(3-methyl-1~{H}-indazol-6-yl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-2-carboxamide

ChemComp-HOH:
WATER

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase / inhibitor / aC-helix / cancer

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