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Cryoem structure of the MDA5-dsrna filament with 87-degree helical twist

Analyse Cryoem structure of the MDA5-dsrna filament with 87-degree helical twist in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6G1S
Type
protein + RNA
Length
675 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Interferon-induced helicase C domain-containing protein 1; RNA…
EC
3.6.4.13
UniProt
Q8R5F7
Ligands
ZN
Pockets
13 · best druggability 0.87

Structure

electron microscopy · 3 distinct chains · 48% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInterferon-induced helicase C domain-containing protein 1 (EC 3.6.4.13)protein64548% helix, 10% 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111550.870.88122empty
29120.790.8263empty
35110.750.8352empty
4640.690.9619empty
52980.680.8234empty

Interfaces

3 interfaces between chains.

  • A–Y · 1070 Ų buried · 22 hydrogen bonds · protein-nucleic
  • A–X · 1019 Ų buried · 11 hydrogen bonds · protein-nucleic
  • X–Y · 727 Ų buried · 69 hydrogen bonds · nucleic-nucleic

Compared structures

  • 6G1S · CryoEM structure of the MDA5-dsRNA filament with 87-degree helical twist · 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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