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MolNFT v1 · #123048 · protein

Crystal structure of glycoprotein C from puumala virus in the post- fusion conformation (pH 6.0)

5J81 · Envelopment polyprotein: “Crystal structure of glycoprotein C from puumala virus in the post- fusion conformation (pH 6.0)”. X-ray diffraction, 3 ligands (NAG, BMA, SO4), 2 pockets (best druggability 0.56). MolNFT v1 #123048 on…

PDB
5J81
Type
protein
Length
411 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Envelopment polyprotein
UniProt
P41266
Ligands
NAG, BMA, SO4
Pockets
2 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 53% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEnvelopment polyproteinprotein4116% helix, 53% strandP41266

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 copies · chains A
  • BMA · beta-D-mannopyranose · sugar
  • SO4 · Sulfate ion · ion · chains A
  • P33 · 3,6,9,12,15,18-hexaoxaicosane-1,20-diol · additive · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13930.560.7452SO4
22580.530.7637empty

Modifications

Observed in the structure: 12 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 5J81 · Crystal structure of Glycoprotein C from Puumala virus in the post-fusion conformation… · the same entry in another collection · chain A against A, TM-score 1.00

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