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MolNFT v1 · #127876 · protein

Crystal structure of human protein kinase CK2 catalytic subunit in complex with the ATP-competitive, tight-binding dibenzofuran inhibitor TF85 (4A)

5N9N: “Crystal structure of human protein kinase CK2 catalytic subunit in complex with the ATP-competitive…”. X-ray diffraction, 1 ligand (KC5). MolNFT v1 #127876 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5N9N
Type
protein
Length
329 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P68400
Ligands
KC5

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein329—P68400

Ligands and binding sites

  • KC5 · (4~{Z})-7,9-bis(chloranyl)-4-[[(4-methoxyphenyl) amino]methylidene]-8-oxidanyl-1,2-dihydrodibenzofuran-3-one · ligand · chains A
  • ACT · Acetate ion · additive · 5 copies · chains A
  • GOL · Glycerol · additive · 5 copies · chains A

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

Compared structures

  • 5N9N · Crystal structure of human Protein kinase CK2 catalytic subunit in complex with the… · the same entry in another collection · chain A against A, TM-score 1.00
  • P68400 · AlphaFold monomer V2.0 prediction for casein kinase II subunit alpha (P68400) · a predicted model of the same protein · chain A against A, TM-score 0.99

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