2025-09-13_00000096|ligand|9JJ5

CDK2 and its inhibitor DC56; X-ray diffraction 1.71Å
Protein #1 303 residues (94% resolved)

GPLGSMENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIREISLLKELNHPNIVKLLDVIHTENKLYLVFEFLHQDLKKFMDASALTGIPLPLIKSYLFQLLQGLAFCHSHRVLHRDLKPQNLLINTEGAIKLADFGLARAFGVPVRTYTHEVVTLWYRAPEILLGCKYYSTAVDIWSLGCIFAEMVTRRALFPGDSEIDQLFRIFRTLGTPDEVVWPGVTSMPDYKPSFPKWARQDFSKVVPPLDEDGRSLLSQMLHYDPNKRISAKAALAHPFFQDVTKPVPHLRL

GPLGSMENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIREISLLKELNHPNIVKLLDVIHTENKLYLVFEFLHQDLKKFMDASALTGIPLPLIKSYLFQLLQGLAFCHSHRVLHRDLKPQNLLINTEGAIKLADFGLARAFGVPVRTYTHEVVTLWYRAPEILLGCKYYSTAVDIWSLGCIFAEMVTRRALFPGDSEIDQLFRIFRTLGTPDEVVWPGVTSMPDYKPSFPKWARQDFSKVVPPLDEDGRSLLSQMLHYDPNKRISAKAALAHPFFQDVTKPVPHLRL
Non polymer #2 A1EB0

InChI=1S/C25H26F2N6O3/c1-29-23(34)14-4-2-13(3-5-14)17-10-11-18(26)20(21(17)27)24(35)32-19-12-30-33-22(19)25(36)31-16-8-6-15(28)7-9-16/h2-5,10-12,15-16H,6-9,28H2,1H3,(H,29,34)(H,30,33)(H,31,36)(H,32,35)/t15-,16+

CNC(=O)c1ccc(cc1)c2ccc(c(c2F)C(=O)Nc3c[nH]nc3C(=O)NC4CCC(CC4)N)F
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Reference