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Crystal structure of KEAP1 in complex with phosphorylated P62

Analyse Crystal structure of KEAP1 in complex with phosphorylated P62 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3WDZ
Type
protein
Length
296 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Kelch-like ech-associated protein 1; Peptide from sequestosome-1
UniProt
Q9Z2X8, Q64337
Pockets
1 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 1% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AKelch-like ech-associated protein 1protein2851% helix, 52% strandQ9Z2X8
BPeptide from sequestosome-1protein110% helix, 18% strandQ64337

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15210.740.8254empty

Interfaces

1 interface between chains.

  • A–B · 530 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 modified (phosphorylation).

Compared structures

  • 3WDZ · Crystal Structure of Keap1 in Complex with phosphorylated p62 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9Z2X8 · AlphaFold monomer V2.0 prediction for kelch-like ech-associated protein 1 (Q9Z2X8) · a predicted model of the same protein · chain A against A, TM-score 1.00
  • Q64337 · AlphaFold monomer V2.0 prediction for sequestosome-1 (Q64337) · a predicted model of the same protein · chain B against A, TM-score 0.54

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