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MolNFT v1 · #121689 · protein

Prefusion form of the vesicular stomatitis virus glycoprotein G ectodomain

5I2S: “Prefusion form of the vesicular stomatitis virus glycoprotein G ectodomain”. X-ray diffraction, 2 ligands (NAG, YB), 5 pockets (best druggability 0.70). MolNFT v1 #121689 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5I2S
Type
protein
Length
413 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycoprotein G
UniProt
P0C2X0
Ligands
NAG, YB
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 15% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycoprotein Gprotein41315% helix, 36% strandP0C2X0

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains A
  • YB · Ytterbium (III) ion · metal · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1570.700.9716empty
21400.600.8425empty
31010.390.7726empty
4770.350.7615empty
5730.310.7314empty

Modifications

Observed in the structure: 6 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 5I2S · Prefusion form of the vesicular stomatitis virus glycoprotein G ectodomain · the same entry in another collection · chain A against A, TM-score 1.00

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