2026-04-18_00000147
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ligand
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9OLE
Crystal Structure of PI5P4KIIAlpha complex with 066ATZ;
X-ray diffraction 2.40Å
Protein #1
377 residues (83% resolved)
Raw Sequence ...
GSHMASDPLLSVLMWGVNHSINELSHVQIPVMLMPDDFKAYSKIKVDNHLFNKENMPSHFKFKEYCPMVFRNLRERFGIDDQDFQNSLTRSAPLPNDSQARSGARFHTSYDKRYIIKTITSEDVAEMHNILKKYHQYIVECHGITLLPQFLGMYRLNVDGVEIYVIVTRNVFSHRLSVYRKYDLKGSTVAREASDKEKAKELPTLKDNDFINEGQKIYIDDNNKKVFLEKLKKDVEFLAQLKLMDYSLLVGIHDVERAEQEEVECEENDGEEEGESDGTHPVGTPPDSPGNTLNSSPPLAPGEFDPNIDVYGIKCHENSPRKEVYFMAIIDILTHYDAKKKAAHAAKTVKHGAGAEISTVNPEQYSKRFLDFIGHIL
Canonical Sequence ...
GSHMASDPLLSVLMWGVNHSINELSHVQIPVMLMPDDFKAYSKIKVDNHLFNKENMPSHFKFKEYCPMVFRNLRERFGIDDQDFQNSLTRSAPLPNDSQARSGARFHTSYDKRYIIKTITSEDVAEMHNILKKYHQYIVECHGITLLPQFLGMYRLNVDGVEIYVIVTRNVFSHRLSVYRKYDLKGSTVAREASDKEKAKELPTLKDNDFINEGQKIYIDDNNKKVFLEKLKKDVEFLAQLKLMDYSLLVGIHDVERAEQEEVECEENDGEEEGESDGTHPVGTPPDSPGNTLNSSPPLAPGEFDPNIDVYGIKCHENSPRKEVYFMAIIDILTHYDAKKKAAHAAKTVKHGAGAEISTVNPEQYSKRFLDFIGHIL
Non polymer #2
A1CCL
InChI=1S/C22H23N11OS/c1-32-16-11-24-21(27-22-25-12-17(35-22)18-28-30-31-29-18)26-19(16)33(14-7-2-3-8-14)15(20(32)34)10-13-6-4-5-9-23-13/h4-6,9,11-12,14-15H,2-3,7-8,10H2,1H3,(H,24,25,26,27)(H,28,29,30,31)
InChI=1S/C22H23N11OS/c1-32-16-11-24-21(27-22-25-12-17(35-22)18-28-30-31-29-18)26-19(16)33(14-7-2-3-8-14)15(20(32)34)10-13-6-4-5-9-23-13/h4-6,9,11-12,14-15H,2-3,7-8,10H2,1H3,(H,24,25,26,27)(H,28,29,30,31)
SMILES: CN1c2cnc(nc2N([C@@H](C1=O)Cc3ccccn3)C4CCCC4)Nc5ncc(s5)c6[nH]nnn6
CN1c2cnc(nc2N([C@@H](C1=O)Cc3ccccn3)C4CCCC4)Nc5ncc(s5)c6[nH]nnn6
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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