2026-04-04_00000277
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ligand
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9UAU
CDK2_LL-DA-3;
X-ray diffraction 1.47Å
Protein #1
303 residues (100% resolved)
Raw Sequence ...
GPLGSMENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIREISLLKELNHPNIVKLLDVIHTENKLYLVFEFLHQDLKKFMDASALTGIPLPLIKSYLFQLLQGLAFCHSHRVLHRDLKPQNLLINTEGAIKLADFGLARAFGVPVRTYTHEVVTLWYRAPEILLGCKYYSTAVDIWSLGCIFAEMVTRRALFPGDSEIDQLFRIFRTLGTPDEVVWPGVTSMPDYKPSFPKWARQDFSKVVPPLDEDGRSLLSQMLHYDPNKRISAKAALAHPFFQDVTKPVPHLRL
Canonical Sequence ...
GPLGSMENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIREISLLKELNHPNIVKLLDVIHTENKLYLVFEFLHQDLKKFMDASALTGIPLPLIKSYLFQLLQGLAFCHSHRVLHRDLKPQNLLINTEGAIKLADFGLARAFGVPVRTYTHEVVTLWYRAPEILLGCKYYSTAVDIWSLGCIFAEMVTRRALFPGDSEIDQLFRIFRTLGTPDEVVWPGVTSMPDYKPSFPKWARQDFSKVVPPLDEDGRSLLSQMLHYDPNKRISAKAALAHPFFQDVTKPVPHLRL
Non polymer #2
A1EOM
InChI=1S/C17H23N9O3S/c1-30(28,29)25-5-2-13(3-6-25)23-17-22-10-12-8-11(9-18)15(27)26(14(12)24-17)7-4-21-16(19)20/h8,10,13H,2-7H2,1H3,(H4,19,20,21)(H,22,23,24)
InChI=1S/C17H23N9O3S/c1-30(28,29)25-5-2-13(3-6-25)23-17-22-10-12-8-11(9-18)15(27)26(14(12)24-17)7-4-21-16(19)20/h8,10,13H,2-7H2,1H3,(H4,19,20,21)(H,22,23,24)
SMILES: [H]/N=C(\N)/NCCN1c2c(cnc(n2)NC3CCN(CC3)S(=O)(=O)C)C=C(C1=O)C#N
[H]/N=C(\N)/NCCN1c2c(cnc(n2)NC3CCN(CC3)S(=O)(=O)C)C=C(C1=O)C#N
Biounit #1
monomer
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Model
Reference
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