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Crystal structure of the spop btb domain complexed with the CUL3 N- terminal domain

Analyse Crystal structure of the spop btb domain complexed with the CUL3 N- terminal… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4EOZ
Type
protein
Length
833 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Speckle-type poz protein; Cullin-3
UniProt
O43791, Q13618
Pockets
3 · best druggability 0.50

Structure

x-ray diffraction · 4 distinct chains · 74% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASpeckle-type poz proteinprotein11457% helix, 12% strandO43791
CSpeckle-type poz proteinprotein11659% helix, 12% strandO43791
BCullin-3protein30280% helix, 0% strandQ13618
DCullin-3protein30179% helix, 0% strandQ13618

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1920.500.8225empty
2770.460.8220empty
3500.230.7214empty

Interfaces

3 interfaces between chains.

  • A–C · 1364 Ų buried · 10 hydrogen bonds · protein-protein
  • C–D · 866 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 858 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 modified (engineered).

Compared structures

  • 4EOZ · Crystal structure of the SPOP BTB domain complexed with the Cul3 N-terminal domain · the same entry in another collection · chain A against A, TM-score 1.00
  • O43791 · AlphaFold monomer V2.0 prediction for speckle-type poz protein (O43791) · a predicted model of the same protein · chain C against A, TM-score 0.99
  • Q13618 · AlphaFold monomer V2.0 prediction for cullin-3 (Q13618) · a predicted model of the same protein · chain B against A, TM-score 0.98

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