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Crystal structure of a DNA polymerase III alpha-epsilon chimera

Analyse Crystal structure of a DNA polymerase III alpha-epsilon chimera in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4GX8
Type
protein
Length
1,242 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA polymerase III subunit EPSILON,DNA polymerase III subunit alpha
EC
2.7.7.7
UniProt
P03007, P10443
Ligands
CL
Pockets
10 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA polymerase III subunit EPSILON,DNA polymerase III subunit alpha (EC 2.7.7.7)protein30647% helix, 14% strandP03007, P10443
B, C, DDNA polymerase III subunit EPSILON,DNA polymerase III subunit alpha (EC 2.7.7.7)protein31244% helix, 14% strandP03007, P10443

Ligands and binding sites

  • CL · Chloride ion · ion · 4 copies · chains A, B, C, D

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

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111060.770.79125empty
27660.760.81114empty
33760.610.7746empty
42140.600.8129empty
51480.530.8024CL

Interfaces

4 interfaces between chains.

  • C–D · 591 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 562 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 410 Ų buried · 3 hydrogen bonds · protein-protein
  • B–D · 381 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 4GX8 · Crystal structure of a DNA polymerase III alpha-epsilon chimera · the same entry in another collection · chain A against A, TM-score 1.00
  • P10443 · AlphaFold monomer V2.0 prediction for DNA polymerase III subunit alpha (P10443) · a predicted model of the same protein · chain B against A, TM-score 0.85
  • P03007 · AlphaFold monomer V2.0 prediction for DNA polymerase III subunit epsilon (P03007) · a predicted model of the same protein · chain D against A, TM-score 0.25

Analyse

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