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Crystal structure of helicobacter pylori T4SS protein cagl in a cubic crystal form with a distorted helical conformation of the rgd-motif

Analyse Crystal structure of helicobacter pylori T4SS protein cagl in a cubic crystal… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZCI
Type
protein
Length
191 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cag pathogenicity island protein (CAG18)
UniProt
O25272
Ligands
BU9, SO4, CL
Pockets
1 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 87% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACag pathogenicity island protein (CAG18)protein19187% helix, 0% strandO25272

Ligands and binding sites

  • BU9 · Meso-2,3-Butanediol · ligand · 3 copies · chains A
  • SO4 · Sulfate ion · ion · 3 copies · chains A
  • CL · Chloride ion · ion · chains A
  • DIO · 1,4-diethylene dioxide · additive · 3 copies · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1790.440.8117DIO

Modifications

Observed in the structure: 5 modified (engineered).

Compared structures

  • 3ZCI · Crystal structure of Helicobacter pylori T4SS protein CagL in a cubic crystal form with a… · the same entry in another collection · chain A against A, TM-score 1.00

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