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Crystal structure of full-length human peroxiredoxin 4 with mixed conformation

Analyse Crystal structure of full-length human peroxiredoxin 4 with mixed conformation in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3TKQ
Type
protein
Length
873 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peroxiredoxin-4
EC
1.11.1.15
UniProt
Q13162
Pockets
4 · best druggability 0.45

Structure

x-ray diffraction · 4 distinct chains · 29% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeroxiredoxin-4 (EC 1.11.1.15)protein19128% helix, 26% strandQ13162
BPeroxiredoxin-4 (EC 1.11.1.15)protein18527% helix, 26% strandQ13162
C, EPeroxiredoxin-4 (EC 1.11.1.15)protein16630% helix, 28% strandQ13162
DPeroxiredoxin-4 (EC 1.11.1.15)protein16532% helix, 28% strandQ13162

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1730.450.8221empty
2690.440.8117empty
3630.430.8216empty
4640.390.7915empty

Interfaces

2 interfaces between chains.

  • A–E · 64 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 43 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3TKQ · Crystal structure of full-length human peroxiredoxin 4 with mixed conformation · the same entry in another collection · chain E against E, TM-score 1.00
  • Q13162 · AlphaFold monomer V2.0 prediction for peroxiredoxin-4 (Q13162) · a predicted model of the same protein · chain D against A, TM-score 1.00

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