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Satellite tobacco mosaic virus refined to 1.4 a resolution using icosahedral constraints

Analyse Satellite tobacco mosaic virus refined to 1.4 a resolution using icosahedral… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4OQ8
Type
protein + RNA
Length
165 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Coat protein; RNA (5'-R(P*AP*AP*AP*AP*AP*AP*AP*AP*AP*A)-3'); RNA…
UniProt
P17574
Ligands
MG, SO4, PO4
Pockets
3 · best druggability 0.51

Structure

x-ray diffraction · 4 distinct chains · 7% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACoat proteinprotein1447% helix, 40% strandP17574
BRNA (5'-R(P*AP*AP*AP*AP*AP*AP*AP*AP*AP*A)-3')rna10——
CRNA (5'-R(P*UP*UP*UP*UP*UP*UP*UP*UP*UP*U)-3')rna10——
DRNA (5'-R(P*UP*U)-3')rna1——

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • PO4 · Phosphate ion · ion · chains A

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

Pockets

3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1670.510.8516empty
22510.500.7617empty
31120.410.7720empty

Interfaces

5 interfaces between chains.

  • B–C · 508 Ų buried · 49 hydrogen bonds · nucleic-nucleic
  • A–C · 196 Ų buried · 3 hydrogen bonds · protein-nucleic
  • A–B · 143 Ų buried · 2 hydrogen bonds · protein-nucleic
  • A–D · 115 Ų buried · 0 hydrogen bonds · protein-nucleic
  • C–D · 87 Ų buried · 5 hydrogen bonds · nucleic-nucleic

Compared structures

  • 4OQ8 · Satellite Tobacco Mosaic Virus Refined to 1.4 A Resolution using icosahedral constraints · the same entry in another collection · chain A against A, TM-score 1.00

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