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Mouse endonuclease G mutant H97A bound to a-DNA

Analyse Mouse endonuclease G mutant H97A bound to a-DNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6NJU
Type
protein + DNA
Length
914 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Endonuclease G, mitochondrial; DNA (5'-D(CCGGCGCCGG)-3')
EC
3.1.30.-
UniProt
O08600
Ligands
MG, CL
Pockets
16 · best druggability 0.75

Structure

x-ray diffraction · 5 distinct chains · 27% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEndonuclease G, mitochondrial (EC 3.1.30.-)protein22326% helix, 30% strandO08600
BEndonuclease G, mitochondrial (EC 3.1.30.-)protein22827% helix, 30% strandO08600
CEndonuclease G, mitochondrial (EC 3.1.30.-)protein22427% helix, 31% strandO08600
DEndonuclease G, mitochondrial (EC 3.1.30.-)protein22927% helix, 31% strandO08600
EDNA (5'-D(CCGGCGCCGG)-3')dna10——

Ligands and binding sites

  • MG · Magnesium ion · metal · 4 copies · chains A, B, C, D
  • CL · Chloride ion · ion · 4 copies · chains A, C, D
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · chains D, E

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

Pockets

16 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11870.750.9134CL
22350.730.8845empty
3540.690.9726empty
41930.520.7726MG
51600.490.7822MG

Interfaces

5 interfaces between chains.

  • C–D · 2841 Ų buried · 38 hydrogen bonds · protein-protein
  • A–B · 2764 Ų buried · 37 hydrogen bonds · protein-protein
  • D–E · 109 Ų buried · 2 hydrogen bonds · protein-nucleic
  • B–D · 67 Ų buried · 1 hydrogen bond · protein-protein
  • B–C · 45 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6NJU · Mouse endonuclease G mutant H97A bound to A-DNA · the same entry in another collection · chain E against E, TM-score 1.00
  • O08600 · AlphaFold monomer V2.0 prediction for endonuclease G, mitochondrial (O08600) · a predicted model of the same protein · chain A against A, TM-score 0.99

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