2026-09-05_00000204
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ligand
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9SIZ
CK1d in complex with IG138;
X-ray diffraction 1.50Å
Protein #1
296 residues (98% resolved)
Raw Sequence ...
SMMELRVGNRYRLGRKIGSGSFGDIYLGTDIAAGEEVAIKLECVKTKHPQLHIESKIYKMMQGGVGIPTIRWCGAEGDYNVMVMELLGPSLEDLFNFCSRKFSLKTVLLLADQMISRIEYIHSKNFIHRDVKPDNFLMGLGKKGNLVYIIDFGLAKKYRDARTHQHIPYRENKNLTGTARYASINTHLGIEQSRRDDLESLGYVLMYFNLGSLPWQGLKAATKRQKYERISEKKMSTPIEVLCKGYPSEFATYLNFCRSLRFDDKPDYSYLRQLFRNLFHRQGFSYDYVFDWNMLK
Canonical Sequence ...
SMMELRVGNRYRLGRKIGSGSFGDIYLGTDIAAGEEVAIKLECVKTKHPQLHIESKIYKMMQGGVGIPTIRWCGAEGDYNVMVMELLGPSLEDLFNFCSRKFSLKTVLLLADQMISRIEYIHSKNFIHRDVKPDNFLMGLGKKGNLVYIIDFGLAKKYRDARTHQHIPYRENKNLTGTARYASINTHLGIEQSRRDDLESLGYVLMYFNLGSLPWQGLKAATKRQKYERISEKKMSTPIEVLCKGYPSEFATYLNFCRSLRFDDKPDYSYLRQLFRNLFHRQGFSYDYVFDWNMLK
Non polymer #2
A1JOD
InChI=1S/C20H21FN6/c21-15-3-1-13(2-4-15)17-18(14-5-9-23-10-6-14)27-20(19(22)26-17)25-16-7-11-24-12-8-16/h1-6,9-10,16,24H,7-8,11-12H2,(H2,22,26)(H,25,27)
InChI=1S/C20H21FN6/c21-15-3-1-13(2-4-15)17-18(14-5-9-23-10-6-14)27-20(19(22)26-17)25-16-7-11-24-12-8-16/h1-6,9-10,16,24H,7-8,11-12H2,(H2,22,26)(H,25,27)
SMILES: c1cc(ccc1c2c(nc(c(n2)N)NC3CCNCC3)c4ccncc4)F
c1cc(ccc1c2c(nc(c(n2)N)NC3CCNCC3)c4ccncc4)F
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #4
MLI
InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/p-2
InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)/p-2
SMILES: C(C(=O)[O-])C(=O)[O-]
C(C(=O)[O-])C(=O)[O-]
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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