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MolNFT v1 · #48516 · protein

Crystal structure of the catalytic subunit of protein kinase CK2 (C- terminal deletion mutant 1-335) in complex with two sulfate ions

2PVR · Casein kinase II subunit alpha, catalytic subunit: “Crystal structure of the catalytic subunit of protein kinase CK2 (C- terminal deletion mutant 1-335) in…”. X-ray diffraction, 2 ligands (ANP, SO4), 3 pockets (best druggability…

PDB
2PVR
Type
protein
Length
328 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Casein kinase II subunit alpha, catalytic subunit
EC
2.7.11.1
UniProt
P68400
Ligands
ANP, SO4
Pockets
3 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACasein kinase II subunit alpha, catalytic subunit (EC 2.7.11.1)protein32841% helix, 15% strandP68400

Ligands and binding sites

  • ANP · Phosphoaminophosphonic acid-adenylate ester · ligand · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14420.680.8043ANP
2620.440.8218empty
3540.280.7513empty

Compared structures

  • 2PVR · Crystal structure of the catalytic subunit of protein kinase CK2 (C-terminal deletion… · 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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