2026-01-10_00000008
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ligand
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7I84
Crystal Structure of APL1867 bound to CK2a;
X-ray diffraction 1.97Å
Protein #1
328 residues (100% resolved)
Raw Sequence ...
SGPVPSRARVYTDVNTHRPSEYWDYESHVVEWGNQDDYQLVRKLGRGKYSEVFEAINITNNEKVVVKILKPVAAAKIKREIKILENLRGGPNIITLADIVKDPVSRTPALVFEHVNNTDFKQLYQTLTDYDIRFYMYEILKALDYCHSMGIMHRDVKPHNVMIDHEHRKLRLIDWGLAEFYHPGQEYNVRVASRYFKGPELLVDYQMYDYSLDMWSLGCMLASMIFRKEPFFHGHDNYDQLVRIAKVLGTEDLYDYIDKYNIELDPRFNDILGRHSRKRWERFVHSENQHLVSPEALDFLDKLLRYDHQSRLTAREAMEHPYFYTVVK
Canonical Sequence ...
SGPVPSRARVYTDVNTHRPSEYWDYESHVVEWGNQDDYQLVRKLGRGKYSEVFEAINITNNEKVVVKILKPVAAAKIKREIKILENLRGGPNIITLADIVKDPVSRTPALVFEHVNNTDFKQLYQTLTDYDIRFYMYEILKALDYCHSMGIMHRDVKPHNVMIDHEHRKLRLIDWGLAEFYHPGQEYNVRVASRYFKGPELLVDYQMYDYSLDMWSLGCMLASMIFRKEPFFHGHDNYDQLVRIAKVLGTEDLYDYIDKYNIELDPRFNDILGRHSRKRWERFVHSENQHLVSPEALDFLDKLLRYDHQSRLTAREAMEHPYFYTVVK
Non polymer #2
A1BZY
InChI=1S/C33H35ClN6O3S/c1-44(42,43)40-33(41)25-10-12-27-29-22-37-16-13-28(29)32(39-31(27)20-25)38-18-17-35-14-5-6-15-36-21-23-9-11-26(30(34)19-23)24-7-3-2-4-8-24/h2-4,7-13,16,19-20,22,35-36H,5-6,14-15,17-18,21H2,1H3,(H,38,39)(H,40,41)
InChI=1S/C33H35ClN6O3S/c1-44(42,43)40-33(41)25-10-12-27-29-22-37-16-13-28(29)32(39-31(27)20-25)38-18-17-35-14-5-6-15-36-21-23-9-11-26(30(34)19-23)24-7-3-2-4-8-24/h2-4,7-13,16,19-20,22,35-36H,5-6,14-15,17-18,21H2,1H3,(H,38,39)(H,40,41)
SMILES: CS(=O)(=O)NC(=O)c1ccc2c(c1)nc(c3c2cncc3)NCCNCCCCNCc4ccc(c(c4)Cl)c5ccccc5
CS(=O)(=O)NC(=O)c1ccc2c(c1)nc(c3c2cncc3)NCCNCCCCNCc4ccc(c(c4)Cl)c5ccccc5
Non polymer #3
ACT
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
SMILES: CC(=O)[O-]
CC(=O)[O-]
Biounit #1
monomer
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Model
Reference
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