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MS2-RNA hairpin (2SU -5-6) complex

Analyse MS2-RNA hairpin (2SU -5-6) complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2C4Z
Type
protein + RNA
Length
417 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Coat protein; 5'-R(*AP*CP*AP*UP*GP*AP*GP*GP*AP*SUR *SUR*AP*CP*CP*CP*AP*UP*GP*U)-3'
UniProt
P03612
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 3 distinct chains · 19% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CCoat proteinprotein12919% helix, 46% strandP03612
R5'-R(*AP*CP*AP*UP*GP*AP*GP*GP*AP*SUR *SUR*AP*CP*CP*CP*AP*UP*GP*U)-3'rna17——
S5'-R(*AP*CP*AP*UP*GP*AP*GP*GP*AP*SUR *SUR*AP*CP*CP*CP*AP*UP*GP*U)-3'rna13——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14870.700.8044empty
24510.640.7743empty
34600.620.7548empty
4940.330.7316empty
51160.330.7216empty

Interfaces

5 interfaces between chains.

  • A–B · 3322 Ų buried · 45 hydrogen bonds · protein-protein
  • A–C · 514 Ų buried · 4 hydrogen bonds · protein-protein
  • B–R · 432 Ų buried · 15 hydrogen bonds · protein-nucleic
  • A–R · 427 Ų buried · 10 hydrogen bonds · protein-nucleic
  • C–S · 349 Ų buried · 8 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 4 modified (nucleotide modification).

Compared structures

  • 2C4Z · MS2-RNA hairpin (2SU -5-6) complex · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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