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Argonaute-2 - 5'-(E)-vinylphosphonate 2'-O-methyl-uridine modified mrttr guide RNA complex

Analyse Argonaute-2 - 5'-(E)-vinylphosphonate 2'-O-methyl-uridine modified mrttr guide… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5T7B
Type
protein + RNA
Length
813 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (UVP)UAUAGAGCAAGAACACUGUU; Protein argonaute-2
EC
3.1.26.-
UniProt
Q9UKV8
Ligands
IPH
Pockets
10 · best druggability 0.83

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
RRNA (UVP)UAUAGAGCAAGAACACUGUUrna11——
AProtein argonaute-2 (EC 3.1.26.-)protein80231% helix, 29% strandQ9UKV8

Ligands and binding sites

  • IPH · Phenol · ligand · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19720.830.8585empty
21190.490.8021empty
31370.480.7824empty
4990.450.7917empty
51610.430.7418empty

Interfaces

1 interface between chains.

  • R–A · 1890 Ų buried · 53 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 5T7B · Argonaute-2 - 5'-(E)-vinylphosphonate 2'-O-methyl-uridine modified mrTTR guide RNA complex · the same entry in another collection · chain R against R, 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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