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Crystal structure of 9-mer peptide from influenza virus in complex with BF2*1201

Analyse Crystal structure of 9-mer peptide from influenza virus in complex with BF2*1201 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5YMV
Type
protein
Length
756 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Class I histocompatibility antigen, F10 alpha chain; Beta-2-microglobulin…
UniProt
P15979, P21611
Pockets
7 · best druggability 0.76

Structure

x-ray diffraction · 3 distinct chains · 20% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DClass I histocompatibility antigen, F10 alpha chainprotein27128% helix, 43% strandP15979
B, EBeta-2-microglobulinprotein980% helix, 48% strandP21611
C, FAla-val-lys-gly-val-gly-thr-met-valprotein90% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111410.760.79108empty
27050.720.7862empty
34770.630.7652empty
41560.430.7520empty
5620.410.8120empty

Interfaces

5 interfaces between chains.

  • A–B · 1614 Ų buried · 25 hydrogen bonds · protein-protein
  • D–E · 1593 Ų buried · 23 hydrogen bonds · protein-protein
  • A–D · 944 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 885 Ų buried · 15 hydrogen bonds · protein-protein
  • D–F · 884 Ų buried · 19 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 5YMV · Crystal structure of 9-mer peptide from influenza virus in complex with BF2*1201 · the same entry in another collection · chain F against F, TM-score 1.00
  • P15979 · AlphaFold monomer V2.0 prediction for class I histocompatibility antigen, F10 alpha chain… · a predicted model of the same protein · chain A against A, TM-score 0.98
  • P21611 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P21611) · a predicted model of the same protein · chain B against A, TM-score 0.96

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