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Crystal structure of the SKP1-FBXO31 complex

Analyse Crystal structure of the SKP1-FBXO31 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5VZT
Type
protein
Length
1,123 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
S-phase kinase-associated protein 1; F-box only protein 31
UniProt
P63208, Q5XUX0
Ligands
ZN, PO4
Pockets
11 · best druggability 0.84

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AS-phase kinase-associated protein 1protein14555% helix, 8% strandP63208
BF-box only protein 31protein41830% helix, 30% strandQ5XUX0
CS-phase kinase-associated protein 1protein14355% helix, 8% strandP63208
DF-box only protein 31protein41732% helix, 29% strandQ5XUX0

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains B, D
  • PO4 · Phosphate ion · ion · 8 copies · chains B, D
  • DTT · 2,3-dihydroxy-1,4-dithiobutane · additive · 2 copies · chains B, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13910.840.9253empty
23550.830.9254empty
3780.730.9619empty
4770.720.9617empty
52280.510.7638DTT

Interfaces

3 interfaces between chains.

  • A–B · 1619 Ų buried · 21 hydrogen bonds · protein-protein
  • C–D · 1603 Ų buried · 11 hydrogen bonds · protein-protein
  • A–D · 251 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 5VZT · Crystal structure of the Skp1-FBXO31 complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q5XUX0 · AlphaFold monomer V2.0 prediction for F-box only protein 31 (Q5XUX0) · a predicted model of the same protein · chain D against A, TM-score 1.00
  • P63208 · AlphaFold monomer V2.0 prediction for S-phase kinase-associated protein 1 (P63208) · a predicted model of the same protein · chain C against A, TM-score 0.94

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