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Crystal structures of the murine class I major histocompatibility complex H-2DB in complex with lcmv-derived GP33 index peptide and three of its escape variants

Analyse Crystal structures of the murine class I major histocompatibility complex H-2DB… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1S7V
Type
protein
Length
768 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
H-2 class I histocompatibility antigen, D-B alpha chain; Beta-2-microglobulin…
UniProt
P01899, P01887, P07399
Pockets
11 · best druggability 0.66

Structure

x-ray diffraction · 3 distinct chains · 19% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DH-2 class I histocompatibility antigen, D-B alpha chainprotein27626% helix, 39% strandP01899
B, EBeta-2-microglobulinprotein990% helix, 47% strandP01887
C, FGlycoprotein 9-residue peptideprotein90% helix, 0% strandP07399

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14250.660.7943empty
23820.640.7841empty
31030.440.7823empty
41150.430.7722empty
5600.420.8217empty

Interfaces

4 interfaces between chains.

  • D–E · 1413 Ų buried · 28 hydrogen bonds · protein-protein
  • A–B · 1401 Ų buried · 27 hydrogen bonds · protein-protein
  • D–F · 909 Ų buried · 26 hydrogen bonds · protein-protein
  • A–C · 905 Ų buried · 27 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 1S7V · Crystal structures of the murine class I major histocompatibility complex H-2Db in… · the same entry in another collection · chain C against C, TM-score 1.00
  • P01887 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P01887) · a predicted model of the same protein · chain E against A, TM-score 0.97

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