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Sorla VPS10P domain in complex with its own propeptide fragment

Analyse Sorla VPS10P domain in complex with its own propeptide fragment in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3WSY
Type
protein
Length
673 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sortilin-related receptor; Peptide from sortilin-related receptor
UniProt
Q92673
Ligands
NAG
Pockets
8 · best druggability 0.68

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASortilin-related receptorprotein6626% helix, 42% strandQ92673
CPeptide from sortilin-related receptorprotein110% helix, 36% strandQ92673

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 5 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1520.680.9715empty
25850.650.7553empty
33220.530.7446empty
4940.400.7819empty
5880.380.7720empty

Interfaces

1 interface between chains.

  • A–C · 857 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide, 5 glycan (disulfide, N-glycosylation).

Compared structures

  • 3WSY · SorLA Vps10p domain in complex with its own propeptide fragment · the same entry in another collection · chain A against A, TM-score 1.00
  • Q92673 · AlphaFold monomer V2.0 prediction for sortilin-related receptor (Q92673) · a predicted model of the same protein · chain A against A, TM-score 0.93

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