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Crystal structure of murine class I MHC H2-db complexed with a synthetic peptide P1027

Analyse Crystal structure of murine class I MHC H2-db complexed with a synthetic… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1BZ9
Type
protein
Length
382 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (class I histocompatibility antigen); Protein (peptide P1027 (fapgvfpym))
UniProt
P01899, P01887
Pockets
3 · best druggability 0.62

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein (class I histocompatibility antigen)protein27326% helix, 38% strandP01899
BProtein (class I histocompatibility antigen)protein1000% helix, 49% strandP01887
CProtein (peptide P1027 (fapgvfpym))protein90% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15100.620.7545empty
21450.470.7731empty
3860.390.7818empty

Interfaces

2 interfaces between chains.

  • A–B · 1292 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 863 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 1BZ9 · Crystal structure of murine class I MHC H2-db complexed with a synthetic peptide P1027 · the same entry in another collection · chain A against A, TM-score 1.00
  • P01887 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P01887) · a predicted model of the same protein · chain B against A, TM-score 0.98

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