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2.0A Crystal Structure of a Glutamate-1-Semialdehyde Aminotransferase from Yersinia pestis CO92

Analyse 2.0A Crystal Structure of a Glutamate-1-Semialdehyde Aminotransferase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4E77
Type
protein
Length
406 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2
Source
Yersinia pestis
Molecule
Glutamate-1-semialdehyde 2,1-aminomutase
EC
5.4.3.8
UniProt
A4TPW6
Ligands
NA, NO3
Pockets
3 · best druggability 0.56

Structure

x-ray diffraction · resolution 2 · 1 distinct chain · 42% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutamate-1-semialdehyde 2,1-aminomutase (EC 5.4.3.8)protein40642% helix, 17% strandA4TPW6

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • NO3 · Nitrate ion · ion · 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
12440.560.7734empty
22250.520.7726NO3
3580.310.7512empty

Modifications

Observed in the structure: 17 modified (engineered).

Compared structures

  • 4E77 · 2.0A crystal structure of a glutamate-1-semialdehyde aminotransferase from yersinia… · the same entry in another collection · chain A against A, TM-score 1.00
  • A4TPW6 · AlphaFold monomer V2.0 prediction for glutamate-1-semialdehyde 2,1-aminomutase (A4TPW6) · a predicted model of the same protein · chain A against A, TM-score 0.99

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