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Unprecedented sculpting of DNA at abasic sites by DNA glycosylase homolog MAG2

Analyse Unprecedented sculpting of DNA at abasic sites by DNA glycosylase homolog MAG2 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4B22
Type
protein + DNA
Length
227 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MAG2, DNA-3-methyladenine glycosylase 2; 5'-D(*GP*CP*TP*AP*CP*(3DR)P*CP*AP*TP*CP*GP)-3'…
EC
3.2.2.21
UniProt
O94468
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 3 distinct chains · 63% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMAG2, DNA-3-methyladenine glycosylase 2 (EC 3.2.2.21)protein20563% helix, 0% strandO94468
X5'-D(*GP*CP*TP*AP*CP*(3DR)P*CP*AP*TP*CP*GP)-3'dna11——
Y5'-D(*CP*GP*AP*TP*GP*GP*GP*TP*AP*GP*CP)-3'dna11——

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16670.700.7841empty

Interfaces

3 interfaces between chains.

  • A–X · 550 Ų buried · 13 hydrogen bonds · protein-nucleic
  • X–Y · 473 Ų buried · 42 hydrogen bonds · nucleic-nucleic
  • A–Y · 462 Ų buried · 8 hydrogen bonds · protein-nucleic

Modifications

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

Compared structures

  • 4B22 · Unprecedented sculpting of DNA at abasic sites by DNA glycosylase homolog Mag2 · the same entry in another collection · chain A against A, TM-score 1.00
  • O94468 · AlphaFold monomer V2.0 prediction for alkylbase DNA glycosidase-like protein MAG2 (O94468) · a predicted model of the same protein · chain A against A, TM-score 0.99

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