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Structure of respiratory syncytial virus F protein head domain

Analyse Structure of respiratory syncytial virus F protein head domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4CCF
Type
protein
Length
1,574 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fusion glycoprotein F0
UniProt
G8EJ09
Ligands
SO4
Pockets
18 · best druggability 0.82

Structure

x-ray diffraction · 6 distinct chains · 19% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFusion glycoprotein F0protein26517% helix, 48% strandG8EJ09
BFusion glycoprotein F0protein25819% helix, 47% strandG8EJ09
CFusion glycoprotein F0protein26120% helix, 48% strandG8EJ09
DFusion glycoprotein F0protein26818% helix, 47% strandG8EJ09
EFusion glycoprotein F0protein25720% helix, 47% strandG8EJ09
FFusion glycoprotein F0protein26519% helix, 48% strandG8EJ09

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 3 copies · chains C, D, E, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18440.820.85137empty
23640.730.8465empty
32060.730.8932SO4
42310.710.8732empty
52160.700.8748empty

Interfaces

9 interfaces between chains.

  • D–F · 1843 Ų buried · 23 hydrogen bonds · protein-protein
  • E–F · 1611 Ų buried · 22 hydrogen bonds · protein-protein
  • D–E · 1605 Ų buried · 19 hydrogen bonds · protein-protein
  • A–C · 1539 Ų buried · 18 hydrogen bonds · protein-protein
  • B–C · 1536 Ų buried · 19 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 disulfide (disulfide).

Compared structures

  • 4CCF · Structure of Respiratory Syncytial Virus F protein head domain · the same entry in another collection · chain F against F, TM-score 1.00

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