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TitleDesign and Discovery of a Potent and Selective Inhibitor of Integrin alpha v beta 1.
Journal, issue, pagesJ. Med. Chem., Vol. 67, Page 10306-10320, Year 2024
Publish dateFeb 21, 2024 (structure data deposition date)
AuthorsSabat, M. / Carney, D.W. / Hernandez-Torres, G. / Gibson, T.S. / Balakrishna, D. / Zou, H. / Xu, R. / Chen, C.H. / de Jong, R. / Dougan, D.R. ...Sabat, M. / Carney, D.W. / Hernandez-Torres, G. / Gibson, T.S. / Balakrishna, D. / Zou, H. / Xu, R. / Chen, C.H. / de Jong, R. / Dougan, D.R. / Qin, L. / Bigi-Botterill, S.V. / Chambers, A. / Miura, J. / Johnson, L.K. / Ermolieff, J. / Johns, D. / Selimkhanov, J. / Kwok, L. / DeMent, K. / Proffitt, C. / Vu, P. / Lindsey, E.A. / Ivetac, T. / Jennings, A. / Wang, H. / Manam, P. / Santos, C. / Fullenwider, C. / Manohar, R. / Flick, A.C.
External linksJ. Med. Chem. / PubMed:38872300
MethodsX-ray diffraction
Resolution2.45 Å
Structure data

PDB-8w30:
Crystal structure of alpha-V beta-1 integrin headpiece in complex with TR01225179
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

Chemicals

ChemComp-CA:
Unknown entry

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

PDB-1afa:
STRUCTURAL BASIS OF GALACTOSE RECOGNITION IN C-TYPE ANIMAL LECTINS

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsCELL ADHESION / membrane receptor

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