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CryoEM structure of the MDA5-dsRNA filament with 93 degree twist and without nucleotide

Analyse CryoEM structure of the MDA5-dsRNA filament with 93 degree twist and without… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H66
Type
protein + RNA
Length
697 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
4.16
Source
Mus musculus; SYNTHETIC CONSTRUCT
Molecule
Interferon-induced helicase C domain-containing protein 1; RNA…
EC
3.6.4.13
UniProt
Q8R5F7
Ligands
ZN
Pockets
14 · best druggability 0.86

Structure

electron microscopy · resolution 4.16 · 3 distinct chains · 48% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInterferon-induced helicase C domain-containing protein 1 (EC 3.6.4.13)protein66748% helix, 11% strandQ8R5F7
XRNA (5'-R(P*UP*CP*CP*AP*UP*GP*CP*GP*CP*AP*UP*GP*AP*CP*G)-3')rna15——
YRNA (5'-R(P*CP*GP*UP*CP*AP*UP*GP*CP*GP*CP*AP*UP*GP*GP*A)-3')rna15——

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A

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

Pockets

14 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111060.860.88116empty
23470.720.8451empty
33130.720.8524empty
42760.700.8542empty
51180.680.9024empty

Interfaces

3 interfaces between chains.

  • A–Y · 1008 Ų buried · 19 hydrogen bonds · protein-nucleic
  • A–X · 974 Ų buried · 13 hydrogen bonds · protein-nucleic
  • X–Y · 722 Ų buried · 62 hydrogen bonds · nucleic-nucleic

Compared structures

  • 6H66 · Cryoem structure of the MDA5-dsrna filament with 93 degree twist and without nucleotide · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8R5F7 · AlphaFold monomer V2.0 prediction for interferon-induced helicase C domain-containing… · a predicted model of the same protein · chain A against A, TM-score 0.97

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