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DICER2-loqs-pd-dsrna complex at early-translocation state

Analyse DICER2-loqs-pd-dsrna complex at early-translocation state in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7W0C
Type
protein + RNA
Length
1,564 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dicer-2, isoform a; Loquacious, isoform D; RNA (35-mer)
EC
3.1.21.1, 3.1.26.-, 3.1.26.3, 3.6.1.3
UniProt
A1ZAW0, M9MRT5
Ligands
ADP, MG
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 4 distinct chains · 47% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADicer-2, isoform a (EC 3.1.21.1, 3.1.26.-, 3.1.26.3, 3.6.1.3)protein147648% helix, 11% strandA1ZAW0
BLoquacious, isoform Dprotein160% helix, 6% strandM9MRT5
CRNA (35-mer)rna35——
DRNA (35-mer)rna37——

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal

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

Pockets

20 pockets found on a 1 Å grid, 16 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17410.830.8669empty
21470.770.9533empty
33810.770.8767empty
45120.740.8363empty
53080.740.8647empty

Interfaces

4 interfaces between chains.

  • C–D · 1692 Ų buried · 192 hydrogen bonds · nucleic-nucleic
  • A–D · 1152 Ų buried · 27 hydrogen bonds · protein-nucleic
  • A–B · 1106 Ų buried · 12 hydrogen bonds · protein-protein
  • A–C · 948 Ų buried · 18 hydrogen bonds · protein-nucleic

Compared structures

  • 7W0C · Dicer2-Loqs-PD-dsRNA complex at early-translocation state · the same entry in another collection · chain A against A, TM-score 1.00

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