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Crystal structure of human ARGONAUTE2 bound to tryptophan

Analyse Crystal structure of human ARGONAUTE2 bound to tryptophan in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4OLB
Type
protein + RNA
Length
803 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein argonaute-2; 5'-R(P*AP*AP*AP*AP*AP*AP*AP*AP*AP*U)-3'
EC
3.1.26.-
UniProt
Q9UKV8
Ligands
TRP
Pockets
6 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 31% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein argonaute-2 (EC 3.1.26.-)protein79431% helix, 29% strandQ9UKV8
B5'-R(P*AP*AP*AP*AP*AP*AP*AP*AP*AP*U)-3'rna9——

Ligands and binding sites

  • TRP · Tryptophan · ligand · 2 copies · chains A

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

Pockets

6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15420.730.8161empty
27310.730.7953empty
31220.460.7829empty
4930.410.7822empty
5730.400.7915empty

Interfaces

1 interface between chains.

  • A–B · 1561 Ų buried · 44 hydrogen bonds · protein-nucleic

Compared structures

  • 4OLB · Crystal Structure of Human Argonaute2 Bound to Tryptophan · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UKV8 · AlphaFold monomer V2.0 prediction for protein argonaute-2 (Q9UKV8) · a predicted model of the same protein · chain A against A, TM-score 0.97

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