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Structure of group a streptococcal enolase K362A mutant

Analyse Structure of group a streptococcal enolase K362A mutant in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZLG
Type
protein
Length
1,732 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Enolase
EC
4.2.1.11
UniProt
Q5XD01
Ligands
PO4
Pockets
18 · best druggability 0.85

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DEnolase (EC 4.2.1.11)protein43342% helix, 18% strandQ5XD01

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 8 copies · chains A, B, C, D

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

Pockets

18 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12940.850.9635empty
210090.780.8050empty
33290.700.8338empty
42920.630.8037empty
53000.620.7936empty

Interfaces

3 interfaces between chains.

  • C–D · 1827 Ų buried · 40 hydrogen bonds · protein-protein
  • A–B · 1234 Ų buried · 16 hydrogen bonds · protein-protein
  • B–D · 241 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 3ZLG · Structure of group A Streptococcal enolase K362A mutant · the same entry in another collection · chain D against D, TM-score 1.00
  • Q5XD01 · AlphaFold monomer V2.0 prediction for enolase (Q5XD01) · a predicted model of the same protein · chain C against A, TM-score 1.00

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