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VCAM4I restriction endonuclease in the absence of DNA

Analyse VCAM4I restriction endonuclease in the absence of DNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6YEX
Type
protein
Length
612 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hnh endonuclease
UniProt
A0A344KQF3
Ligands
CL, SO4
Pockets
6 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 38% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHnh endonucleaseprotein30938% helix, 19% strandA0A344KQF3
BHnh endonucleaseprotein30339% helix, 18% strandA0A344KQF3

Ligands and binding sites

  • CL · Chloride ion · ion · 12 copies · chains A, B
  • SO4 · Sulfate ion · ion · 7 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110690.830.8489empty
21390.390.7319empty
31210.380.7424empty
4690.350.7714empty
5640.340.7716empty

Interfaces

1 interface between chains.

  • A–B · 2297 Ų buried · 34 hydrogen bonds · protein-protein

Compared structures

  • 6YEX · VcaM4I restriction endonuclease in the absence of DNA · the same entry in another collection · chain A against A, TM-score 1.00

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