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Crystal structure of the glycoprotein VI loop truncation mutant pavs- papykn

Analyse Crystal structure of the glycoprotein VI loop truncation mutant pavs- papykn in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5OU7
Type
protein
Length
702 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Platelet glycoprotein VI
UniProt
Q9HCN6
Ligands
NAG, CL, PO4
Pockets
1 · best druggability 0.28

Structure

x-ray diffraction · 2 distinct chains · 2% helix, 53% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPlatelet glycoprotein VIprotein1732% helix, 55% strandQ9HCN6
C, DPlatelet glycoprotein VIprotein1782% helix, 51% strandQ9HCN6

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A, B, C, D
  • CL · Chloride ion · ion · 14 copies · chains A, B, C, D
  • PO4 · Phosphate ion · ion · 2 copies · chains A, B
  • PG6 · 1-(2-methoxy-ethoxy)-2-{2-[2-(2-methoxy-ethoxy]-ethoxy}-ethane · additive · 2 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1510.280.7412PG6

Interfaces

2 interfaces between chains.

  • A–C · 873 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 871 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide, 4 glycan (disulfide, N-glycosylation).

Compared structures

  • 5OU7 · Crystal structure of the Glycoprotein VI loop truncation mutant PAVS-PAPYKN · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9HCN6 · AlphaFold monomer V2.0 prediction for platelet glycoprotein VI (Q9HCN6) · a predicted model of the same protein · chain A against A, TM-score 0.88

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