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Structure of a bacterial polysialyltransferase at 2.75 ångström resolution

Analyse Structure of a bacterial polysialyltransferase at 2.75 ångström resolution in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5WC8
Type
protein
Length
762 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Siad
UniProt
G4RIN4
Ligands
BR
Pockets
6 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
M, ASiadprotein38144% helix, 15% strandG4RIN4

Ligands and binding sites

  • BR · Bromide ion · ion · 36 copies · chains M, A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19570.720.7668BR
24290.670.7951empty
33270.540.7442BR
41070.400.7621BR
51290.370.7318empty

Interfaces

1 interface between chains.

  • M–A · 1081 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 5WC8 · Structure of a bacterial polysialyltransferase at 2.75 Angstrom resolution · the same entry in another collection · chain M against M, TM-score 1.00

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