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MolNFT v1 · #118874 · protein + DNA

Tdg enzyme-product complex

5FF8 · G/T mismatch-specific thymine DNA glycosylase: “Tdg enzyme-product complex”. X-ray diffraction, 3 pockets (best druggability 0.69). MolNFT v1 #118874 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5FF8
Type
protein + DNA
Length
255 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
G/T mismatch-specific thymine DNA glycosylase; DNA
EC
3.2.2.29
UniProt
Q13569
Pockets
3 · best druggability 0.69

Structure

x-ray diffraction · 3 distinct chains · 42% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AG/T mismatch-specific thymine DNA glycosylase (EC 3.2.2.29)protein19942% helix, 12% strandQ13569
CDNAdna28——
DDNAdna28——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16810.690.7733empty
21760.680.8823empty
3880.380.7723empty

Interfaces

3 interfaces between chains.

  • C–D · 1232 Ų buried · 126 hydrogen bonds · nucleic-nucleic
  • A–D · 794 Ų buried · 25 hydrogen bonds · protein-nucleic
  • A–C · 525 Ų buried · 5 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 5FF8 · TDG enzyme-product complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13569 · AlphaFold monomer V2.0 prediction for G/T mismatch-specific thymine DNA glycosylase… · a predicted model of the same protein · chain A against A, TM-score 0.97

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