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GP1 receptor-binding domain from whitewater arroyo mammarenavirus

Analyse GP1 receptor-binding domain from whitewater arroyo mammarenavirus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5NSJ
Type
protein
Length
284 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pre-glycoprotein polyprotein gp complex
UniProt
Q911P0
Ligands
NAG, MAN, SM
Pockets
2 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 27% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPre-glycoprotein polyprotein gp complexprotein14227% helix, 25% strandQ911P0

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 7 copies · chains A, B
  • MAN · alpha-D-mannopyranose · sugar
  • SM · Samarium (III) ion · metal · 7 copies · chains A, B

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
1800.760.9719empty
21220.500.8033SM

Interfaces

1 interface between chains.

  • A–B · 574 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide, 4 glycan (disulfide, N-glycosylation).

Compared structures

  • 5NSJ · GP1 receptor-binding domain from Whitewater Arroyo mammarenavirus · the same entry in another collection · chain A against A, TM-score 1.00

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