2025-02-08_00000281|ligand|9GZH

PDGFRA-T674I in complex with covalent ponatinib derivative 19; X-ray diffraction 2.20Å
Protein #1 355 residues (79% resolved)

GPGKQKPRYEIRWRVIESISPDGHEYIYVDPMQLPYDSRWEFPRDGLVLGRVLGSGAFGKVVEGTAYGLSRSQPVMKVAVKMLKPTARSSEKQALMSELKIMTHLGPHLNIVNLLGACTKSGPIYIIIEYCFYGDLVNYLHKNRDSFLSHKKKSMLDSEVKNLLSDDNSEGLTLLDLLSFTYQVARGMEFLASKNCVHRDLAARNVLLAQGKIVKICDFGLARDIMHDSNYVSKGSTFLPVKWMAPESIFDNLYTTLSDVWSYGILLWEIFSLGGTPYPGMMVDSTFYNKIKSGYRMAKPDHATSEVYEIMVKCWNSEPEKRPSFYHLSEIVENLLPGQYKKSYEKIHLDFLKSD

GPGKQKPRYEIRWRVIESISPDGHEYIYVDPMQLPYDSRWEFPRDGLVLGRVLGSGAFGKVVEGTAYGLSRSQPVMKVAVKMLKPTARSSEKQALMSELKIMTHLGPHLNIVNLLGACTKSGPIYIIIEYCFYGDLVNYLHKNRDSFLSHKKKSMLDSEVKNLLSDDNSEGLTLLDLLSFTYQVARGMEFLASKNCVHRDLAARNVLLAQGKIVKICDFGLARDIMHDSNYVSKGSTFLPVKWMAPESIFDNLYTTLSDVWSYGILLWEIFSLGGTPYPGMMVDSTFYNKIKSGYRMAKPDHATSEVYEIMVKCWNSEPEKRPSFYHLSEIVENLLPGQYKKSYEKIHLDFLKSD
Non polymer #2 A1IRC

InChI=1S/C26H20F3N5O2/c1-3-24(35)33-22-11-9-19(14-21(22)26(27,28)29)32-25(36)18-7-6-16(2)17(13-18)8-10-20-15-30-23-5-4-12-31-34(20)23/h4-7,9,11-15H,3H2,1-2H3,(H,32,36)(H,33,35)

CCC(=O)Nc1ccc(cc1C(F)(F)F)NC(=O)c2ccc(c(c2)C#Cc3cnc4n3nccc4)C
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Reference