GL1X · GenesisL1 explorer

MolNFT v1 · #58813 · protein

Structure of a poxvirus IFNGBP/IFNG complex

3BES · Interferon gamma: “Structure of a poxvirus IFNGBP/IFNG complex”. X-ray diffraction, 3 ligands (NAG, BMA, PO4), 3 pockets (best druggability 0.74). MolNFT v1 #58813 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3BES
Type
protein
Length
383 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Interferon gamma; Interferon-gamma binding protein C4R
UniProt
P01579, Q66793
Ligands
NAG, BMA, PO4
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LInterferon gammaprotein13368% helix, 0% strandP01579
RInterferon-gamma binding protein C4Rprotein25020% helix, 41% strandQ66793

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains R
  • BMA · beta-D-mannopyranose · sugar
  • PO4 · Phosphate ion · ion · 3 copies · chains L, R

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110330.740.7658empty
2900.390.7718empty
3560.300.7515empty

Interfaces

1 interface between chains.

  • L–R · 686 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 3BES · Structure of a Poxvirus ifngbp/ifng Complex · the same entry in another collection · chain L against L, TM-score 1.00
  • P01579 · AlphaFold monomer V2.0 prediction for interferon gamma (P01579) · a predicted model of the same protein · chain L against A, TM-score 0.97

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