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Crystal structure of chimeric hemagglutinin CH15/3 in complex with broad protective antibody 31.A.83

Analyse Crystal structure of chimeric hemagglutinin CH15/3 in complex with broad… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7U8L
Type
protein
Length
933 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hemagglutinin HA1 subunit; Hemagglutinin HA2 subunit; Antibody Fab light chain; Antibody…
UniProt
A0A2Z4LK48
Pockets
10 · best druggability 0.75

Structure

x-ray diffraction · 4 distinct chains · 15% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHemagglutinin HA1 subunitprotein3218% helix, 36% strand—
BHemagglutinin HA2 subunitprotein17351% helix, 15% strandA0A2Z4LK48
LAntibody Fab light chainprotein2134% helix, 46% strand—
HAntibody Fab heavy chainprotein2265% helix, 46% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110010.750.7784empty
21540.570.8228empty
32160.460.7431empty
4780.410.7922empty
51340.400.7424empty

Interfaces

6 interfaces between chains.

  • A–B · 2612 Ų buried · 29 hydrogen bonds · protein-protein
  • L–H · 1896 Ų buried · 17 hydrogen bonds · protein-protein
  • B–H · 658 Ų buried · 6 hydrogen bonds · protein-protein
  • A–L · 296 Ų buried · 3 hydrogen bonds · protein-protein
  • B–L · 180 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 9 disulfide (disulfide).

Compared structures

  • 7U8L · Crystal structure of chimeric hemagglutinin cH15/3 in complex with broad protective… · the same entry in another collection · chain A against A, TM-score 1.00

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