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Glycogen synthase kinase-3 beta (GSK3) complex with a covalent [1,2, 4]TRIAZOLO[1,5-A][1,3,5]TRIAZINE inhibitor

Analyse Glycogen synthase kinase-3 beta (GSK3) complex with a covalent [1,2… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H0U
Type
protein
Length
696 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P49841
Ligands
FKB, NA, CL

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein348—P49841

Ligands and binding sites

  • FKB · (2~{R})-3-[7-azanyl-5-(cyclohexylamino)-[1,2, 4]triazolo[1,5-a][1,3,5]triazin-2-yl]-2-cyano-propanamide · ligand · 2 copies · chains A, B
  • NA · Sodium ion · metal · chains B
  • CL · Chloride ion · ion · 2 copies · chains B
  • GOL · Glycerol · additive · 3 copies · chains A, B
  • MLI · Malonate ion · additive · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6H0U · Glycogen synthase kinase-3 beta (GSK3) complex with a covalent… · the same entry in another collection · chain A against A, TM-score 1.00

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