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MolNFT v2 · #152370 · protein

LOW-SALT STRUCTURE OF PROTEIN KINASE CK2 CATALYTIC SUBUNIT (ISOFORM CK2ALPHA; CSNK2A1 gene product) IN COMPLEX WITH THE INDENOINDOLE-TYPE INHIBITOR THN27

6HME: “LOW-SALT STRUCTURE OF PROTEIN KINASE CK2 CATALYTIC SUBUNIT (ISOFORM CK2ALPHA; CSNK2A1 gene product) IN…”. X-ray diffraction at 1.85, 4 ligands (FXB, NA, SO4). MolNFT v2 #152370 on GenesisL1: 3D structure, binding sites and pockets…

PDB
6HME
Type
protein
Length
664 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.85
Source
Homo sapiens
UniProt
P68400
Ligands
FXB, NA, SO4, CL

Structure

x-ray diffraction · resolution 1.85 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein332—P68400

Ligands and binding sites

  • FXB · 5-propan-2-yl-4-prop-2-enoxy-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione · ligand · 2 copies · chains A, B
  • NA · Sodium ion · metal · chains B
  • SO4 · Sulfate ion · ion · 10 copies · chains A, B
  • CL · Chloride ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A, B

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

Compared structures

  • 6HME · Low-salt structure of protein kinase CK2 catalytic subunit (isoform CK2ALPHA; CSNK2A1… · 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 B against A, TM-score 0.99

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