9XYY
Crystal structure of BTK kinase domain bound to an ibrutinib analog with a 2-butynamide warhead
This is a non-PDB format compatible entry.
Summary for 9XYY
| Entry DOI | 10.2210/pdb9xyy/pdb |
| Related | 9XYV |
| Descriptor | Tyrosine-protein kinase BTK, (2E)-1-{(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl}but-2-en-1-one (3 entities in total) |
| Functional Keywords | inhibitor, kinase, complex, covalent, transferase-transferase inhibitor complex, transferase |
| Biological source | Mus musculus (house mouse) |
| Total number of polymer chains | 1 |
| Total formula weight | 32276.05 |
| Authors | |
| Primary citation | Lin, D.Y.,Joseph, R.E.,Andreotti, A.H. Covalent warheads on clinically approved BTK inhibitors cause distinct dynamic changes within BTK kinase To Be Published, |
| Experimental method | X-RAY DIFFRACTION (2.48 Å) |
Structure validation
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