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Ovine recombinant PRP(114-234), arq variant in complex with the Fab of the VRQ14 antibody

Analyse Ovine recombinant PRP(114-234), arq variant in complex with the Fab of the… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1TPX
Type
protein
Length
533 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Major prion protein; The VRQ14 Fab
UniProt
Q6V654
Pockets
6 · best druggability 0.49

Structure

x-ray diffraction · 3 distinct chains · 18% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMajor prion proteinprotein10260% helix, 4% strandQ6V654
BThe VRQ14 Fabprotein21210% helix, 50% strand—
CThe VRQ14 Fabprotein2195% helix, 50% strand—

Pockets

6 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12630.490.7445empty
21880.490.7629empty
3950.440.7922empty
4810.340.7524empty
5930.330.7321empty

Interfaces

3 interfaces between chains.

  • B–C · 1699 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 550 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 521 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1TPX · Ovine recombinant PrP(114-234), ARQ variant in complex with the Fab of the VRQ14 antibody · the same entry in another collection · chain A against A, TM-score 1.00

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