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Crystal structure of deinococcus radiodurans recn head domain

Analyse Crystal structure of deinococcus radiodurans recn head domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4ABY
Type
protein
Length
1,381 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA repair protein recn
EC
3.6.1.3
UniProt
Q9WXF2
Pockets
4 · best druggability 0.54

Structure

x-ray diffraction · 4 distinct chains · 42% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA repair protein recn (EC 3.6.1.3)protein35843% helix, 27% strandQ9WXF2
BDNA repair protein recn (EC 3.6.1.3)protein36141% helix, 27% strandQ9WXF2
CDNA repair protein recn (EC 3.6.1.3)protein35142% helix, 27% strandQ9WXF2
DDNA repair protein recn (EC 3.6.1.3)protein31143% helix, 26% strandQ9WXF2

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13450.540.7448empty
21930.510.7731empty
3580.330.7710empty
4570.320.7712empty

Interfaces

1 interface between chains.

  • A–B · 259 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 modified (engineered).

Compared structures

  • 4ABY · Crystal structure of Deinococcus radiodurans RecN head domain · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9WXF2 · AlphaFold monomer V2.0 prediction for DNA repair protein recn (Q9WXF2) · a predicted model of the same protein · chain A against A, TM-score 0.99

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