2026-09-05_00000205
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ligand
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9SJ0
CK1d in complex with IG139;
X-ray diffraction 1.75Å
Protein #1
296 residues (98% resolved)
Raw Sequence ...
SMMELRVGNRYRLGRKIGSGSFGDIYLGTDIAAGEEVAIKLECVKTKHPQLHIESKIYKMMQGGVGIPTIRWCGAEGDYNVMVMELLGPSLEDLFNFCSRKFSLKTVLLLADQMISRIEYIHSKNFIHRDVKPDNFLMGLGKKGNLVYIIDFGLAKKYRDARTHQHIPYRENKNLTGTARYASINTHLGIEQSRRDDLESLGYVLMYFNLGSLPWQGLKAATKRQKYERISEKKMSTPIEVLCKGYPSEFATYLNFCRSLRFDDKPDYSYLRQLFRNLFHRQGFSYDYVFDWNMLK
Canonical Sequence ...
SMMELRVGNRYRLGRKIGSGSFGDIYLGTDIAAGEEVAIKLECVKTKHPQLHIESKIYKMMQGGVGIPTIRWCGAEGDYNVMVMELLGPSLEDLFNFCSRKFSLKTVLLLADQMISRIEYIHSKNFIHRDVKPDNFLMGLGKKGNLVYIIDFGLAKKYRDARTHQHIPYRENKNLTGTARYASINTHLGIEQSRRDDLESLGYVLMYFNLGSLPWQGLKAATKRQKYERISEKKMSTPIEVLCKGYPSEFATYLNFCRSLRFDDKPDYSYLRQLFRNLFHRQGFSYDYVFDWNMLK
Non polymer #2
A1JOE
InChI=1S/C17H17FN6/c18-13-3-1-11(2-4-13)14-15(12-5-8-21-9-6-12)24-17(16(20)23-14)22-10-7-19/h1-6,8-9H,7,10,19H2,(H2,20,23)(H,22,24)
InChI=1S/C17H17FN6/c18-13-3-1-11(2-4-13)14-15(12-5-8-21-9-6-12)24-17(16(20)23-14)22-10-7-19/h1-6,8-9H,7,10,19H2,(H2,20,23)(H,22,24)
SMILES: c1cc(ccc1c2c(nc(c(n2)N)NCCN)c3ccncc3)F
c1cc(ccc1c2c(nc(c(n2)N)NCCN)c3ccncc3)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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