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Structure-based insights into self-cleavage by a four-way junctional twister-sister ribozyme

Analyse Structure-based insights into self-cleavage by a four-way junctional… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5Y85
Type
RNA
Length
136 nucleotides
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (5'- R(P*AP*CP*CP*CP*GP*CP*AP*AP*GP*GP*CP*CP*GP*AP*CP*GP*GP*C)-3'); DNA/RNA (50-mer)
Ligands
MG
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CRNA (5'- R(P*AP*CP*CP*CP*GP*CP*AP*AP*GP*GP*CP*CP*GP*AP*CP*GP*GP*C)-3')rna18——
B, DDNA/RNA (50-mer)rna50——

Ligands and binding sites

  • MG · Magnesium ion · metal · 26 copies · chains A, B, C, D

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

Pockets

3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16250.740.8242MG
25100.720.8229MG
32960.630.8129MG

Interfaces

4 interfaces between chains.

  • A–B · 1280 Ų buried · 103 hydrogen bonds · nucleic-nucleic
  • C–D · 1273 Ų buried · 101 hydrogen bonds · nucleic-nucleic
  • B–D · 322 Ų buried · 2 hydrogen bonds · nucleic-nucleic
  • A–C · 85 Ų buried · 1 hydrogen bond · nucleic-nucleic

Compared structures

  • 5Y85 · Structure-based Insights into Self-Cleavage by a Four-way Junctional Twister-Sister… · the same entry in another collection · chain A against A, TM-score 1.00

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