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Three-dimensional structure of theiler murine encephalomyelitis virus (bean strain)

Analyse Three-dimensional structure of theiler murine encephalomyelitis virus (bean… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1TMF
Type
protein
Length
806 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
THEILER'S murine encephalomyelitis virus (subunit VP1); THEILER'S murine…
UniProt
P08544, P13899
Pockets
11 · best druggability 0.80

Structure

x-ray diffraction · 4 distinct chains · 3% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
1THEILER'S murine encephalomyelitis virus (subunit VP1)protein2760% helix, 17% strandP08544
2THEILER'S murine encephalomyelitis virus (subunit VP2)protein2675% helix, 30% strandP08544
3THEILER'S murine encephalomyelitis virus (subunit VP3)protein2323% helix, 24% strandP08544
4THEILER'S murine encephalomyelitis virus (subunit VP4)protein3113% helix, 0% strandP13899

Pockets

11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11570.800.9633empty
25940.770.8479empty
38000.760.8066empty
4880.730.9618empty
53170.590.7739empty

Interfaces

6 interfaces between chains.

  • 1–2 · 2388 Ų buried · 33 hydrogen bonds · protein-protein
  • 1–3 · 1423 Ų buried · 18 hydrogen bonds · protein-protein
  • 2–3 · 810 Ų buried · 10 hydrogen bonds · protein-protein
  • 1–4 · 453 Ų buried · 7 hydrogen bonds · protein-protein
  • 3–4 · 267 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1TMF · Three-dimensional structure of theiler murine encephalomyelitis virus (bean strain) · the same entry in another collection · chain 1 against 1, TM-score 1.00

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