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Human prion protein (PrP) fragment 119-231 (G127V M129 variant) complexed to ICSM 18 (anti-Prp therapeutic antibody) Fab fragment

Analyse Human prion protein (PrP) fragment 119-231 (G127V M129 variant) complexed to… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6SV2
Type
protein
Length
519 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.3
Source
Homo sapiens; Mus musculus
Molecule
Icsm 18-anti-prp therapeutic Fab light chain; Icsm 18-anti-prp therapeutic Fab heavy…
UniProt
P04156
Ligands
SO4
Pockets
2 · best druggability 0.59

Structure

x-ray diffraction · resolution 2.3 · 3 distinct chains · 17% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LIcsm 18-anti-prp therapeutic Fab light chainprotein2106% helix, 51% strand—
HIcsm 18-anti-prp therapeutic Fab heavy chainprotein2086% helix, 55% strand—
AMajor prion proteinprotein10163% helix, 4% strandP04156

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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14850.590.7464empty
2580.270.7311empty

Interfaces

3 interfaces between chains.

  • L–H · 1594 Ų buried · 14 hydrogen bonds · protein-protein
  • H–A · 594 Ų buried · 12 hydrogen bonds · protein-protein
  • L–A · 387 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 6SV2 · Human prion protein (prp) fragment 119-231 (G127V M129 variant) complexed to icsm 18… · the same entry in another collection · chain A against A, TM-score 1.00
  • P04156 · AlphaFold monomer V2.0 prediction for major prion protein (P04156) · a predicted model of the same protein · chain A against A, TM-score 0.96

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