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Crystal structure complex between the lactococcus lactis fpg (mutm) and a fapy-dg containing DNA

Analyse Crystal structure complex between the lactococcus lactis fpg (mutm) and a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1TDZ
Type
protein + DNA
Length
293 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'-D(*CP*TP*CP*TP*TP*TP*(FOX)P*TP*TP*TP*CP*TP*CP*G)-3'…
EC
3.2.2.23
UniProt
P42371
Ligands
ZN
Pockets
5 · best druggability 0.71

Structure

x-ray diffraction · 3 distinct chains · 34% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B5'-D(*CP*TP*CP*TP*TP*TP*(FOX)P*TP*TP*TP*CP*TP*CP*G)-3'dna14——
C5'-D(*GP*CP*GP*AP*GP*AP*AP*AP*CP*AP*AP*AP*GP*A)-3'dna14——
AFormamidopyrimidine-DNA glycosylase (EC 3.2.2.23)protein26534% helix, 23% strandP42371

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • GOL · Glycerol · additive · chains B, A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16240.710.7944empty
21400.630.8621empty
31320.410.7522GOL
4650.340.7715empty
5610.270.7310empty

Interfaces

3 interfaces between chains.

  • B–A · 836 Ų buried · 18 hydrogen bonds · protein-nucleic
  • B–C · 548 Ų buried · 39 hydrogen bonds · nucleic-nucleic
  • C–A · 423 Ų buried · 7 hydrogen bonds · protein-nucleic

Modifications

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

Compared structures

  • 1TDZ · Crystal Structure Complex Between the Lactococcus Lactis FPG (Mutm) and a FAPY-dG… · the same entry in another collection · chain B against B, TM-score 1.00
  • P42371 · AlphaFold monomer V2.0 prediction for formamidopyrimidine-DNA glycosylase (P42371) · a predicted model of the same protein · chain A against A, TM-score 1.00

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