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Crystal structure of glycoprotein C from rift valley fever virus (glycosylated)

Analyse Crystal structure of glycoprotein C from rift valley fever virus (glycosylated) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4HJ1
Type
protein
Length
1,719 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Envelope glycoprotein
UniProt
A2T075
Ligands
NAG, BMA
Pockets
14 · best druggability 0.72

Structure

x-ray diffraction · 3 distinct chains · 6% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DEnvelope glycoproteinprotein4316% helix, 55% strandA2T075
BEnvelope glycoproteinprotein4276% helix, 52% strandA2T075
CEnvelope glycoproteinprotein4304% helix, 55% strandA2T075

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 12 copies · chains A, B, C, D
  • BMA · beta-D-mannopyranose · sugar · 9 copies · chains A, B, C, D
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 5 copies · chains A, B, C, D
  • GOL · Glycerol · additive · 5 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111270.720.76105empty
211250.720.7697empty
32130.530.7839empty
41960.530.7835empty
51710.520.7930empty

Interfaces

4 interfaces between chains.

  • C–D · 1582 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 1501 Ų buried · 12 hydrogen bonds · protein-protein
  • A–C · 76 Ų buried · 2 hydrogen bonds · protein-protein
  • B–C · 44 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 47 disulfide, 8 glycan (disulfide, N-glycosylation).

Compared structures

  • 4HJ1 · Crystal structure of glycoprotein C from Rift Valley Fever Virus (glycosylated) · the same entry in another collection · chain A against A, TM-score 1.00

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