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Ricin toxin in complex with neutralizing single chain monoclonal antibodies (vhhs)

Analyse Ricin toxin in complex with neutralizing single chain monoclonal antibodies… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5E1H
Type
protein
Length
382 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ricin; F8(JOB10) vhh antibody
EC
3.2.2.22
UniProt
P02879
Ligands
CL
Pockets
3 · best druggability 0.56

Structure

x-ray diffraction · 2 distinct chains · 32% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARicin (EC 3.2.2.22)protein25842% helix, 23% strandP02879
BF8(JOB10) vhh antibodyprotein12410% helix, 52% strand—

Ligands and binding sites

  • CL · Chloride ion · ion · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12410.560.7833empty
2510.350.7914empty
3910.350.7520empty

Interfaces

1 interface between chains.

  • A–B · 574 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 5E1H · Ricin toxin in complex with neutralizing single chain monoclonal antibodies (VHHs) · the same entry in another collection · chain A against A, TM-score 1.00

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