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MolNFT v1 · #159830 · protein

Structure of a nested set of N-terminally extended MHC I-peptides provides novel insights into antigen processing and presentation

6P2C · HLA class I histocompatibility antigen, B-8 alpha chain: “Structure of a nested set of N-terminally extended MHC I-peptides provides novel insights into antigen…”. X-ray diffraction, 4 pockets (best druggability 0.68). MolNFT v1…

PDB
6P2C
Type
protein
Length
383 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HLA class I histocompatibility antigen, B-8 alpha chain; Beta-2-microglobulin; MHC…
UniProt
P30460, P61769
Pockets
4 · best druggability 0.68

Structure

x-ray diffraction · 3 distinct chains · 19% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHLA class I histocompatibility antigen, B-8 alpha chainprotein27527% helix, 40% strandP30460
BBeta-2-microglobulinprotein990% helix, 49% strandP61769
CMHC I-peptideprotein90% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15820.680.7852empty
21010.450.7923empty
31160.440.7824empty
4560.260.7314empty

Interfaces

2 interfaces between chains.

  • A–B · 1314 Ų buried · 25 hydrogen bonds · protein-protein
  • A–C · 884 Ų buried · 17 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 6P2C · Structure of a nested set of N-terminally extended MHC I-peptides provides novel insights… · the same entry in another collection · chain A against A, 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 0.98

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