2026-05-16_00000071|ligand|7I92

Crystal Structure of 9 bound to the PH domain of Btk; X-ray diffraction 2.63Å
Protein #1 169 residues (99% resolved)

AAVILESIFLKRSQQKKKTSPLNFKKRLFLLTVHKLSYYEYDFERGRRGSKKGSIDVEKITCVETVVPEKNPPPERQIPRRGEESSEMEQISIIERFPYPFQVVYDEGPLYVFSPTEELRKRWIHQLKNVIRYNSDLVQKYHPSFWIDGQYLCCSQTAKNAMGCQILEN

AAVILESIFLKRSQQKKKTSPLNFKKRLFLLTVHKLSYYEYDFERGRRGSKKGSIDVEKITCVETVVPEKNPPPERQIPRRGEESSEMEQISIIERFPYPFQVVYDEGPLYVFSPTEELRKRWIHQLKNVIRYNSDLVQKYHPSFWIDGQYLCCSQTAKNAMGCQILEN
Non polymer #2 A1B6T

InChI=1S/C21H18O4/c22-21(23)18-13-24-20-12-14(10-11-17(18)20)16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-9,13-14H,10-12H2,(H,22,23)/t14-/m0/s1

c1ccc(cc1)Oc2ccccc2[C@H]3CCc4c(coc4C3)C(=O)O
Non polymer #3 MG

InChI=1S/Mg/q+2

[Mg+2]
Non polymer #4 ZN

InChI=1S/Zn/q+2

[Zn+2]
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Reference