8DJC
CRYSTAL STRUCTURE OF GLYCOGEN SYNTHASE KINASE 3 BETA COMPLEXED WITH (4S)-N-{4-[(2S)-2-methylmorpholin-4-yl] pyridin-3-yl}-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Glycogen synthase kinase-3 beta | polymer | 441 | 49294.8 | 2 | UniProt (P49841) Pfam (PF00069) In PDB | Homo sapiens (human) | GSK-3 beta,Serine/threonine-protein kinase GSK3B |
2 | A, B | (4S)-N-{4-[(2S)-2-methylmorpholin-4-yl]pyridin-3-yl}-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide | non-polymer | 414.5 | 2 | Chemie (UAU) | |||
3 | water | water | 18.0 | 81 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 420 (UniProt: P49841)
PDB | External Database | Details |
---|---|---|
Met -20 | - | initiating methionine |
His -19 | - | expression tag |
Ser -18 | - | expression tag |
Ser -17 | - | expression tag |
His -16 | - | expression tag |
His -15 | - | expression tag |
His -14 | - | expression tag |
His -13 | - | expression tag |
His -12 | - | expression tag |
His -11 | - | expression tag |
Ser -10 | - | expression tag |
Ser -9 | - | expression tag |
Gly -8 | - | expression tag |
Glu -7 | - | expression tag |
Asn -6 | - | expression tag |
Leu -5 | - | expression tag |
Tyr -4 | - | expression tag |
Phe -3 | - | expression tag |
Gln -2 | - | expression tag |
Gly -1 | - | expression tag |
His 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 98589.7 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 828.9 | |
All* | Total formula weight | 99418.6 |