GL1X · GenesisL1 explorer

Research workbench

Structure of influenza a neutralizing antibody selected from cultures of single human plasma cells in complex with human H3 influenza haemagglutinin.

Analyse Structure of influenza a neutralizing antibody selected from cultures of single… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZTJ
Type
protein
Length
2,586 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hemagglutinin HA1 chain; Hemagglutinin HA2 chain; FI6V3 antibody heavy chain; FI6V3…
UniProt
P03437
Ligands
NAG, BMA
Pockets
20 · best druggability 0.86

Structure

x-ray diffraction · 8 distinct chains · 11% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, EHemagglutinin HA1 chainprotein3189% helix, 39% strandP03437
B, D, FHemagglutinin HA2 chainprotein17250% helix, 13% strandP03437
CHemagglutinin HA1 chainprotein31610% helix, 37% strandP03437
GFI6V3 antibody heavy chainprotein1295% helix, 45% strand—
HFI6V3 antibody light chainprotein1070% helix, 32% strand—
IFI6V3 antibody heavy chainprotein2265% helix, 45% strand—
J, LFI6V3 antibody light chainprotein2164% helix, 44% strand—
KFI6V3 antibody heavy chainprotein2245% helix, 50% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 29 copies · chains A, G, E, B, C, I, K, F, D
  • BMA · beta-D-mannopyranose · sugar · 4 copies · chains E, A, C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 19 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18400.860.89132empty
24900.860.9337empty
32590.850.9729empty
48260.770.8091empty
53180.760.8853empty

Interfaces

33 interfaces between chains.

  • A–B · 2837 Ų buried · 43 hydrogen bonds · protein-protein
  • C–D · 2833 Ų buried · 35 hydrogen bonds · protein-protein
  • E–F · 2811 Ų buried · 39 hydrogen bonds · protein-protein
  • K–L · 1828 Ų buried · 14 hydrogen bonds · protein-protein
  • I–J · 1827 Ų buried · 19 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 28 disulfide, 15 glycan (disulfide, N-glycosylation).

Compared structures

  • 3ZTJ · Structure of influenza A neutralizing antibody selected from cultures of single human… · the same entry in another collection · chain E against E, TM-score 1.00

Analyse

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.