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Enterococcus faecalis fic protein (H111A) in complex with sulfate.

Analyse Enterococcus faecalis fic protein (H111A) in complex with sulfate. in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ERB
Type
protein
Length
794 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fic family protein
UniProt
U6S0Y1
Ligands
SO4
Pockets
10 · best druggability 0.85

Structure

x-ray diffraction · 2 distinct chains · 61% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, CFic family proteinprotein19861% helix, 2% strandU6S0Y1
BFic family proteinprotein20061% helix, 2% strandU6S0Y1

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, D, B, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111360.850.8692empty
28730.800.8377SO4
39710.750.7879SO4
4620.700.9721empty
5590.690.9620empty

Interfaces

6 interfaces between chains.

  • A–C · 662 Ų buried · 5 hydrogen bonds · protein-protein
  • D–B · 654 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 433 Ų buried · 10 hydrogen bonds · protein-protein
  • B–C · 413 Ų buried · 9 hydrogen bonds · protein-protein
  • D–C · 264 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 6ERB · Enterococcus faecalis FIC protein (H111A) in complex with sulfate. · the same entry in another collection · chain A against A, TM-score 1.00

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