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Cronobacter turicensis bdsf synthase rpff in complex with the rpfr quorum-sensing receptor fi domain

Analyse Cronobacter turicensis bdsf synthase rpff in complex with the rpfr… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DGN
Type
protein
Length
367 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Rpff; Rpfr
UniProt
A2W0S6, C9XTL5
Ligands
PO4
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 44% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARpffprotein27653% helix, 17% strandA2W0S6
BRpfrprotein9115% helix, 49% strandC9XTL5

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A
  • GOL · Glycerol · additive · 4 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12030.590.8033GOL
2970.390.7620GOL
31130.370.7420empty

Interfaces

1 interface between chains.

  • A–B · 397 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 6DGN · Cronobacter turicensis BDSF synthase RpfF in complex with the RpfR quorum-sensing… · the same entry in another collection · chain A against A, TM-score 1.00

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