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Crystal structure of the holliday junction-resolving enzyme GEN1 (wt) in complex with product DNA, MG2+ and MN2+ ions

Analyse Crystal structure of the holliday junction-resolving enzyme GEN1 (wt) in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5CNQ
Type
protein + DNA
Length
421 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nuclease-like protein; R; DNA (5'-D(*TP*GP*AP*GP*CP*GP*GP*TP*GP*GP*TP*TP*GP*GP*T)- 3')
UniProt
G0RYN2
Ligands
MN
Pockets
7 · best druggability 0.61

Structure

x-ray diffraction · 3 distinct chains · 46% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANuclease-like proteinprotein39246% helix, 14% strandG0RYN2
RRdna15——
HDNA (5'-D(*TP*GP*AP*GP*CP*GP*GP*TP*GP*GP*TP*TP*GP*GP*T)- 3')dna14——

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains A, H

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12240.610.8226empty
23430.600.7830empty
32970.590.7831empty
42030.560.7924empty
5860.530.8527empty

Interfaces

3 interfaces between chains.

  • R–H · 659 Ų buried · 76 hydrogen bonds · nucleic-nucleic
  • A–H · 459 Ų buried · 6 hydrogen bonds · protein-nucleic
  • A–R · 366 Ų buried · 6 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 7 modified (engineered).

Compared structures

  • 5CNQ · Crystal structure of the Holliday junction-resolving enzyme GEN1 (WT) in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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