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Apo IRAK4 kinase domain

Analyse Apo IRAK4 kinase domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2O8Y
Type
protein
Length
557 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Interleukin-1 receptor-associated kinase 4
EC
2.7.11.1
UniProt
Q9NWZ3
Pockets
5 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 42% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInterleukin-1 receptor-associated kinase 4 (EC 2.7.11.1)protein28043% helix, 17% strandQ9NWZ3
BInterleukin-1 receptor-associated kinase 4 (EC 2.7.11.1)protein27742% helix, 16% strandQ9NWZ3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17620.690.7648empty
23810.660.8040empty
32880.650.8137empty
4620.310.7520empty
5560.270.7413empty

Interfaces

1 interface between chains.

  • A–B · 602 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 22 modified (engineered, phosphorylation).

Compared structures

  • 2O8Y · Apo IRAK4 Kinase Domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NWZ3 · AlphaFold monomer V2.0 prediction for interleukin-1 receptor- associated kinase 4 (Q9NWZ3) · a predicted model of the same protein · chain B against A, TM-score 0.99

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