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Crystal structure of the topoisomerase VI holoenzyme from methanosarcina mazei

Analyse Crystal structure of the topoisomerase VI holoenzyme from methanosarcina mazei in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2Q2E
Type
protein
Length
896 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Type II DNA topoisomerase VI subunit a; Type 2 DNA topoisomerase 6 subunit B
EC
5.99.1.3
UniProt
Q8PUB7, Q8PUB8
Pockets
16 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 28% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AType II DNA topoisomerase VI subunit a (EC 5.99.1.3)protein31533% helix, 6% strandQ8PUB7
BType 2 DNA topoisomerase 6 subunit B (EC 5.99.1.3)protein58125% helix, 18% strandQ8PUB8

Pockets

16 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17330.780.8289empty
21220.760.9521empty
31570.740.9127empty
42800.730.8642empty
51210.710.9125empty

Interfaces

1 interface between chains.

  • A–B · 1007 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 2Q2E · Crystal structure of the topoisomerase VI holoenzyme from Methanosarcina mazei · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8PUB7 · AlphaFold monomer V2.0 prediction for type 2 DNA topoisomerase 6 subunit a (Q8PUB7) · a predicted model of the same protein · chain A against A, TM-score 0.96
  • Q8PUB8 · AlphaFold monomer V2.0 prediction for type 2 DNA topoisomerase 6 subunit B (Q8PUB8) · a predicted model of the same protein · chain B against A, TM-score 0.79

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