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The crystal structure of PB1 homo-dimer of human P62/SQSTM1

Analyse The crystal structure of PB1 homo-dimer of human P62/SQSTM1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JM4
Type
protein
Length
322 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sequestosome-1
UniProt
Q13501
Pockets
3 · best druggability 0.65

Structure

x-ray diffraction · 4 distinct chains · 24% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASequestosome-1protein8123% helix, 41% strandQ13501
BSequestosome-1protein7528% helix, 32% strandQ13501
DSequestosome-1protein8423% helix, 33% strandQ13501
CSequestosome-1protein8223% helix, 40% strandQ13501

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11510.650.8729empty
22320.490.7534empty
3920.410.7819empty

Interfaces

5 interfaces between chains.

  • A–B · 540 Ų buried · 9 hydrogen bonds · protein-protein
  • D–C · 524 Ų buried · 12 hydrogen bonds · protein-protein
  • A–D · 389 Ų buried · 5 hydrogen bonds · protein-protein
  • B–C · 70 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 22 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6JM4 · The crystal structure of PB1 homo-dimer of human P62/SQSTM1 · the same entry in another collection · chain C against C, TM-score 1.00
  • Q13501 · AlphaFold monomer V2.0 prediction for sequestosome-1 (Q13501) · a predicted model of the same protein · chain D against A, TM-score 0.97

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