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MolNFT v1 · #62400 · protein

Crystal structure of human protein kinase CK2 regulatory subunit (CK2BETA; mutant 1-193)

3EED · Casein kinase II subunit beta: “Crystal structure of human protein kinase CK2 regulatory subunit (CK2BETA; mutant 1-193)”. X-ray diffraction, 2 ligands (ZN, SO4), 6 pockets (best druggability 0.56). MolNFT v1 #62400 on GenesisL1: 3D…

PDB
3EED
Type
protein
Length
366 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Casein kinase II subunit beta
UniProt
P67870
Ligands
ZN, SO4
Pockets
6 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCasein kinase II subunit betaprotein18343% helix, 10% strandP67870

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 3 copies · chains A, B

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

Pockets

6 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12230.560.7935empty
2860.400.7815empty
3920.390.7717empty
4500.310.7612empty
5560.300.7515empty

Interfaces

1 interface between chains.

  • A–B · 1255 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 3EED · Crystal structure of human protein kinase CK2 regulatory subunit (CK2beta; mutant 1-193) · the same entry in another collection · chain A against A, TM-score 1.00
  • P67870 · AlphaFold monomer V2.0 prediction for casein kinase II subunit beta (P67870) · a predicted model of the same protein · chain A against A, TM-score 0.99

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