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MolNFT v1 · #1756 · protein

Three dimensional structure of the Fab fragment of a neutralizing antibody to human rhinovirus serotype 2

1BBD · IGG2A-kappa 8F5 Fab (light chain): “Three dimensional structure of the Fab fragment of a neutralizing antibody to human rhinovirus serotype 2”. X-ray diffraction, 1 ligand (SO4), 3 pockets (best druggability 0.63). MolNFT v1 #1756…

PDB
1BBD
Type
protein
Length
432 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
IGG2A-kappa 8F5 Fab (light chain); IGG2A-kappa 8F5 Fab (heavy chain)
Ligands
SO4
Pockets
3 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 8% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LIGG2A-kappa 8F5 Fab (light chain)protein2196% helix, 51% strand—
HIGG2A-kappa 8F5 Fab (heavy chain)protein2139% helix, 54% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains H

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16420.630.7462empty
22380.610.8024SO4
3520.320.7714empty

Interfaces

1 interface between chains.

  • L–H · 1881 Ų buried · 20 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1BBD · Three dimensional structure of the Fab fragment of a neutralizing antibody to human… · the same entry in another collection · chain L against L, TM-score 1.00

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