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Crystal structure and assembly of TSP36, a metazoan small heat shock protein

Analyse Crystal structure and assembly of TSP36, a metazoan small heat shock protein in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2BOL
Type
protein
Length
591 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Small heat shock protein
UniProt
Q7YZT0
Ligands
SO4
Pockets
10 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 23% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASmall heat shock proteinprotein30122% helix, 37% strandQ7YZT0
BSmall heat shock proteinprotein29024% helix, 37% strandQ7YZT0

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13360.690.8228empty
23650.660.8026empty
34430.600.7551empty
4770.580.8819empty
5930.560.8617empty

Interfaces

1 interface between chains.

  • A–B · 3288 Ų buried · 42 hydrogen bonds · protein-protein

Compared structures

  • 2BOL · Crystal structure and assembly of TSP36, a metazoan small heat shock protein · the same entry in another collection · chain A against A, TM-score 1.00
  • Q7YZT0 · AlphaFold monomer V2.0 prediction for small heat shock protein P36 (Q7YZT0) · a predicted model of the same protein · chain A against A, TM-score 0.87

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