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Inositol 1,3,4,5,6-pentakisphosphate 2-kinase apo form

Analyse Inositol 1,3,4,5,6-pentakisphosphate 2-kinase apo form in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4AXC
Type
protein
Length
394 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Inositol-pentakisphosphate 2-kinase
EC
2.7.1.158
UniProt
Q93YN9
Ligands
ZN, SO4
Pockets
3 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInositol-pentakisphosphate 2-kinase (EC 2.7.1.158)protein39444% helix, 18% strandQ93YN9

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • SO4 · Sulfate ion · ion · 4 copies · chains A
  • GOL · Glycerol · additive · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16840.730.8061SO4
22450.680.8435SO4
3500.300.7712SO4

Compared structures

  • 4AXC · Inositol 1,3,4,5,6-pentakisphosphate 2-kinase apo form · the same entry in another collection · chain A against A, TM-score 1.00
  • Q93YN9 · AlphaFold monomer V2.0 prediction for inositol-pentakisphosphate 2-kinase (Q93YN9) · a predicted model of the same protein · chain A against A, TM-score 0.94

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