5P9I

BTK1 SOAKED WITH IBRUTINIB-Rev

Summary for 5P9I

Group depositionCrystal structures of Tyrosine-protein kinase BTK in complex with inhibitors (G_1002011)
DescriptorTyrosine-protein kinase BTK, 1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}prop-2-en-1-one, DIMETHYL SULFOXIDE, ... (4 entities in total)
Functional Keywordsprotein kinase, transferase
Biological sourceHomo sapiens (Human)
Cellular locationCytoplasm Q06187
Total number of polymer chains1
Total molecular weight32922.83
Authors
Gardberg, A.S. (deposition date: 2016-09-20, release date: 2017-05-24, Last modification date: 2018-02-21)
Primary citation
Bender, A.T.,Gardberg, A.,Pereira, A.,Johnson, T.,Wu, Y.,Grenningloh, R.,Head, J.,Morandi, F.,Haselmayer, P.,Liu-Bujalski, L.
Ability of Bruton's Tyrosine Kinase Inhibitors to Sequester Y551 and Prevent Phosphorylation Determines Potency for Inhibition of Fc Receptor but not B-Cell Receptor Signaling.
Mol. Pharmacol., 91:208-219, 2017
PubMed: 28062735 (PDB entries with the same primary citation)
DOI: 10.1124/mol.116.107037
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.11 Å)
?

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.2091007.0%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 5p9i
no rotation
Molmil generated image of 5p9i
rotated about x axis by 90°
Molmil generated image of 5p9i
rotated about y axis by 90°
PDBj@FacebookPDBj@TwitterwwPDBwwPDB Foundation

Copyright © 2013-2019 Protein Data Bank Japan