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Cronobacter turicensis RpfR quorum-sensing receptor PAS domain in complex with BDSF

Analyse Cronobacter turicensis RpfR quorum-sensing receptor PAS domain in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DGJ
Type
protein
Length
102 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.294
Source
Cronobacter turicensis (strain DSM 18703 / LMG 23827 / z3032)
Molecule
RpfR
UniProt
C9XTL5
Ligands
GEY
Pockets
1 · best druggability 0.79

Structure

x-ray diffraction · resolution 2.294 · 1 distinct chain · 29% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARpfRprotein10229% helix, 40% strandC9XTL5

Ligands and binding sites

  • GEY · (2Z)-dodec-2-enoic acid · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11140.790.9725GEY

Compared structures

  • 6DGJ · Cronobacter turicensis rpfr quorum-sensing receptor pas domain in complex with bdsf · the same entry in another collection · chain A against A, TM-score 1.00

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