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Immune receptor

Analyse Immune receptor in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1YPZ
Type
protein
Length
1,598 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
H2-T22 protein; Beta-2-microglobulin; T cell receptor delta; T-cell receptor gamma chain
UniProt
P61769
Ligands
NAG, MAN, FUC
Pockets
20 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 8% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CH2-T22 proteinprotein26015% helix, 35% strand—
B, DBeta-2-microglobulinprotein1020% helix, 46% strandP61769
E, GT cell receptor deltaprotein2071% helix, 52% strand—
F, HT-cell receptor gamma chainprotein2308% helix, 43% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 10 copies · chains E, F, G, H
  • MAN · alpha-D-mannopyranose · sugar · 2 copies · chains F, H
  • FUC · alpha-L-fucopyranose · sugar · chains G

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

Pockets

20 pockets found on a 1 Å grid, 11 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19690.700.7591empty
25990.690.7851empty
34790.680.7962empty
45950.670.7748empty
54260.650.7851empty

Interfaces

12 interfaces between chains.

  • E–F · 1838 Ų buried · 10 hydrogen bonds · protein-protein
  • G–H · 1751 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 1373 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 1354 Ų buried · 21 hydrogen bonds · protein-protein
  • C–G · 930 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 14 disulfide, 6 glycan (disulfide, N-glycosylation, glycosylation).

Compared structures

  • 1YPZ · Immune receptor · the same entry in another collection · chain G against G, TM-score 1.00
  • P61769 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P61769) · a predicted model of the same protein · chain B against A, TM-score 0.96

Analyse

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