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Crystal structure of C-terminal fragment of pilus adhesin spac from lactobacillus rhamnosus gg-iodide soaked

Analyse Crystal structure of C-terminal fragment of pilus adhesin spac from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7BVX
Type
protein
Length
258 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pilus assembly protein
UniProt
A0A1Y0DVK9
Ligands
IOD
Pockets
3 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 2% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APilus assembly proteinprotein2582% helix, 45% strandA0A1Y0DVK9

Ligands and binding sites

  • IOD · Iodide ion · ion · 6 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12830.710.8546empty
2690.660.9329empty
3880.390.7721empty

Modifications

Observed in the structure: 2 isopeptide (isopeptide).

Compared structures

  • 7BVX · Crystal structure of C-terminal fragment of pilus adhesin SpaC from Lactobacillus… · the same entry in another collection · chain A against A, TM-score 1.00

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