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Crystal structure of phosphotransferase system component EIIA from Streptococcus agalactiae

Analyse Crystal structure of phosphotransferase system component EIIA from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4TKZ
Type
protein
Length
780 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.8
Source
Streptococcus agalactiae NEM316
Molecule
Putative uncharacterized protein gbs1890
EC
2.7.1.69
UniProt
Q8E371
Pockets
8 · best druggability 0.67

Structure

x-ray diffraction · resolution 1.8 · 1 distinct chain · 48% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, FPutative uncharacterized protein gbs1890 (EC 2.7.1.69)protein13048% helix, 21% strandQ8E371

Ligands and binding sites

  • GOL · Glycerol · additive · 11 copies · chains A, B, F, C, E, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11680.670.8623GOL
21490.530.8014GOL
31470.510.7916empty
42460.490.7434empty
51430.470.7715GOL

Interfaces

6 interfaces between chains.

  • A–B · 1578 Ų buried · 24 hydrogen bonds · protein-protein
  • D–F · 489 Ų buried · 6 hydrogen bonds · protein-protein
  • B–F · 473 Ų buried · 7 hydrogen bonds · protein-protein
  • C–E · 458 Ų buried · 4 hydrogen bonds · protein-protein
  • A–E · 436 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 4TKZ · Crystal structure of phosphotransferase system component eiia from streptococcus… · the same entry in another collection · chain A against A, TM-score 1.00

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