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Structure of Yeast Frequenin bound to PdtIns 4-kinase

Analyse Structure of Yeast Frequenin bound to PdtIns 4-kinase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2JU0
Type
protein
Length
227 residues
Chains
2
Method
solution nmr
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
NOT
Source
Saccharomyces cerevisiae
Molecule
Calcium-binding protein NCS-1; Phosphatidylinositol 4-kinase PIK1
EC
2.7.1.67
UniProt
Q06389, P39104
Ligands
CA
Pockets
5 · best druggability 0.71

Structure

solution nmr · resolution NOT · 2 distinct chains · 53% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACalcium-binding protein NCS-1protein17556% helix, 6% strandQ06389
BPhosphatidylinositol 4-kinase PIK1 (EC 2.7.1.67)protein5244% helix, 0% strandP39104

Ligands and binding sites

  • CA · Calcium ion · metal · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14210.710.8250empty
21150.490.8029empty
3980.370.7516empty
4560.330.7715empty
5550.320.7611empty

Interfaces

1 interface between chains.

  • A–B · 1610 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 2JU0 · Structure of yeast frequenin bound to pdtins 4-kinase · the same entry in another collection · chain A against A, TM-score 1.00
  • Q06389 · AlphaFold monomer V2.0 prediction for calcium-binding protein ncs-1 (Q06389) · a predicted model of the same protein · chain A against A, TM-score 0.85
  • P39104 · AlphaFold monomer V2.0 prediction for phosphatidylinositol 4-kinase PIK1 (P39104) · a predicted model of the same protein · chain B against A, TM-score 0.43

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