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Structure of jev-2F2 Fab complex

Analyse Structure of jev-2F2 Fab complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5YWO
Type
protein
Length
2,588 residues
Chains
10
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Jev E protein; Jev M protein; 2F2 light chain; 2F2 heavy chain
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 4 distinct chains · 17% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, EJev E proteinprotein50019% helix, 34% strand—
B, D, FJev M proteinprotein7453% helix, 0% strand—
M, Q2F2 light chainprotein2156% helix, 45% strand—
N, R2F2 heavy chainprotein2188% helix, 51% strand—

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15140.830.9072empty
24880.770.8558empty
34670.770.8447empty
45730.750.8274empty
58830.710.7678empty

Interfaces

18 interfaces between chains.

  • M–N · 2183 Ų buried · 21 hydrogen bonds · protein-protein
  • Q–R · 1966 Ų buried · 12 hydrogen bonds · protein-protein
  • C–D · 1676 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 1587 Ų buried · 15 hydrogen bonds · protein-protein
  • E–F · 1489 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 21 disulfide (disulfide).

Compared structures

  • 5YWO · Structure of JEV-2F2 Fab complex · the same entry in another collection · chain A against A, TM-score 1.00

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