2026-01-10_00000191
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ligand
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9FT2
Crystal structure of human DYRK1A in complex with ARN25699;
X-ray diffraction 2.90Å
Protein #1
361 residues (95% resolved)
Raw Sequence ...
GPSSHKKERKVYNDGYDDDNYDYIVKNGEKWMDRYEIDSLIGKGSFGQVVKAYDRVEQEWVAIKIIKNKKAFLNQAQIEVRLLELMNKHDTEMKYYIVHLKRHFMFRNHLCLVFEMLSYNLYDLLRNTNFRGVSLNLTRKFAQQMCTALLFLATPELSIIHCDLKPENILLCNPKRSAIKIVDFGSSCQLGQRIYQ(PTR)IQSRFYRSPEVLLGMPYDLAIDMWSLGCILVEMHTGEPLFSGANEVDQMNKIVEVLGIPPAHILDQAPKARKFFEKLPDGTWNLKKTKDGKREYKPPGTRKLHNILGVETGGPGGRRAGESGHTVADYLKFKDLILRMLDYDPKTRIQPYYALQHSFFKKTADE
Canonical Sequence ...
GPSSHKKERKVYNDGYDDDNYDYIVKNGEKWMDRYEIDSLIGKGSFGQVVKAYDRVEQEWVAIKIIKNKKAFLNQAQIEVRLLELMNKHDTEMKYYIVHLKRHFMFRNHLCLVFEMLSYNLYDLLRNTNFRGVSLNLTRKFAQQMCTALLFLATPELSIIHCDLKPENILLCNPKRSAIKIVDFGSSCQLGQRIYQYIQSRFYRSPEVLLGMPYDLAIDMWSLGCILVEMHTGEPLFSGANEVDQMNKIVEVLGIPPAHILDQAPKARKFFEKLPDGTWNLKKTKDGKREYKPPGTRKLHNILGVETGGPGGRRAGESGHTVADYLKFKDLILRMLDYDPKTRIQPYYALQHSFFKKTADE
Non polymer #2
A1IE6
InChI=1S/C21H21N7O2/c22-19(29)14-6-1-3-12(9-14)11-23-21-24-15-7-8-30-18(15)20(26-21)25-17-10-16(27-28-17)13-4-2-5-13/h1,3,6-10,13H,2,4-5,11H2,(H2,22,29)(H3,23,24,25,26,27,28)
InChI=1S/C21H21N7O2/c22-19(29)14-6-1-3-12(9-14)11-23-21-24-15-7-8-30-18(15)20(26-21)25-17-10-16(27-28-17)13-4-2-5-13/h1,3,6-10,13H,2,4-5,11H2,(H2,22,29)(H3,23,24,25,26,27,28)
SMILES: c1cc(cc(c1)C(=O)N)CNc2nc3ccoc3c(n2)Nc4cc(n[nH]4)C5CCC5
c1cc(cc(c1)C(=O)N)CNc2nc3ccoc3c(n2)Nc4cc(n[nH]4)C5CCC5
Biounit #1
monomer
Download coordinates
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Model
Reference
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