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Structure-based mechanism of lipoteichoic acid synthesis by staphylococcus aureus ltas.

Analyse Structure-based mechanism of lipoteichoic acid synthesis by staphylococcus… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2W5Q
Type
protein
Length
424 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Processed glycerol phosphate lipoteichoic acid synthase
UniProt
Q7A1I3
Ligands
MN
Pockets
4 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProcessed glycerol phosphate lipoteichoic acid synthaseprotein42438% helix, 15% strandQ7A1I3

Ligands and binding sites

  • MN · Manganese (II) ion · metal · chains A
  • EDO · 1,2-ethanediol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11640.550.8021empty
2520.460.8518empty
3650.320.7618empty
4770.290.7316empty

Compared structures

  • 2W5Q · Structure-based mechanism of lipoteichoic acid synthesis by Staphylococcus aureus LtaS. · the same entry in another collection · chain A against A, TM-score 1.00
  • Q7A1I3 · AlphaFold monomer V2.0 prediction for lipoteichoic acid synthase (Q7A1I3) · a predicted model of the same protein · chain A against A, TM-score 1.00

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