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Crystal structure of putative periplasmic binding protein from salmonella typhimurium LT2

Analyse Crystal structure of putative periplasmic binding protein from salmonella… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5JG7
Type
protein
Length
290 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fur regulated salmonella iron transporter
UniProt
Q7CPX8
Pockets
2 · best druggability 0.58

Structure

x-ray diffraction · 2 distinct chains · 54% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFur regulated salmonella iron transporterprotein14855% helix, 11% strandQ7CPX8
BFur regulated salmonella iron transporterprotein14254% helix, 12% strandQ7CPX8

Ligands and binding sites

  • GOL · Glycerol · additive · 3 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11740.580.8228GOL
22060.510.7723GOL

Interfaces

1 interface between chains.

  • A–B · 2933 Ų buried · 34 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 5JG7 · Crystal structure of putative periplasmic binding protein from Salmonella typhimurium LT2 · the same entry in another collection · chain A against A, TM-score 1.00

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