2026-01-10_00000434|ligand|9S6M

Structure of BFL1 in complex with a covalent inhibitor, alternative series, cmpd25; X-ray diffraction 1.43Å
Protein #1 152 residues (98% resolved)

GMTDCEFGYIYRLAQDYLQCVLQIPQPGSGPSKTSRVLQNVAFSVQKEVEKNLKSCLDNVNVVSVDTARTLFNQVMEKEFEDGIINWGRIVTIFAFEGILIKKLLRQQIAPDVDTYKEISYFVAEFIMNNTGEWIRQNGGWENGFVKKFEPK

GMTDCEFGYIYRLAQDYLQCVLQIPQPGSGPSKTSRVLQNVAFSVQKEVEKNLKSCLDNVNVVSVDTARTLFNQVMEKEFEDGIINWGRIVTIFAFEGILIKKLLRQQIAPDVDTYKEISYFVAEFIMNNTGEWIRQNGGWENGFVKKFEPK
Non polymer #2 A1JL2

InChI=1S/C24H28F3N3O3/c1-3-22(31)30(18-11-13-19(14-12-18)33-24(25,26)27)15(2)16-7-9-17(10-8-16)29-23(32)20-5-4-6-21(20)28/h7-15,20-21H,3-6,28H2,1-2H3,(H,29,32)/t15-,20-,21-/m1/s1

CCC(=O)N(c1ccc(cc1)OC(F)(F)F)[C@H](C)c2ccc(cc2)NC(=O)[C@@H]3CCC[C@H]3N
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Reference