3I81
Crystal structure of insulin-like growth factor 1 receptor (IGF-1R-WT) complex with BMS-754807 [1-(4-((5-cyclopropyl-1H-pyrazol-3-yl)amino)pyrrolo[2,1-f][1,2,4]triazin-2-yl)-N-(6-fluoro-3-pyridinyl)-2-methyl-L-prolinamide]
Summary for 3I81
Entry DOI | 10.2210/pdb3i81/pdb |
Descriptor | Insulin-like growth factor 1 receptor, 1-{4-[(3-cyclopropyl-1H-pyrazol-5-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl}-N-(6-fluoropyridin-3-yl)-2-methyl-L-proli namide (3 entities in total) |
Functional Keywords | hormone/growth factor, igf-1r, kinase domain, atp-binding, disease mutation, disulfide bond, kinase, membrane, nucleotide-binding, phosphoprotein, polymorphism, receptor, transferase, transmembrane, tyrosine-protein kinase, hormone |
Biological source | Homo sapiens (human) |
Cellular location | Cell membrane ; Single-pass type I membrane protein : P08069 |
Total number of polymer chains | 1 |
Total formula weight | 36371.72 |
Authors | Sack, J.S. (deposition date: 2009-07-09, release date: 2009-12-22, Last modification date: 2024-02-21) |
Primary citation | Wittman, M.D.,Carboni, J.M.,Yang, Z.,Lee, F.Y.,Antman, M.,Attar, R.,Balimane, P.,Chang, C.,Chen, C.,Discenza, L.,Frennesson, D.,Gottardis, M.M.,Greer, A.,Hurlburt, W.,Johnson, W.,Langley, D.R.,Li, A.,Li, J.,Liu, P.,Mastalerz, H.,Mathur, A.,Menard, K.,Patel, K.,Sack, J.,Sang, X.,Saulnier, M.,Smith, D.,Stefanski, K.,Trainor, G.,Velaparthi, U.,Zhang, G.,Zimmermann, K.,Vyas, D.M. Discovery of a 2,4-disubstituted pyrrolo[1,2-f][1,2,4]triazine inhibitor (BMS-754807) of insulin-like growth factor receptor (IGF-1R) kinase in clinical development. J.Med.Chem., 52:7360-7363, 2009 Cited by PubMed: 19778024DOI: 10.1021/jm900786r PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.08 Å) |
Structure validation
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