Exoenzyme T from pseudomonas aeruginosa in complex with human 14-3-3 protein beta, tetrameric crystal form bound to STO1101

Structure

x-ray diffraction · 2 distinct chains · 55% helix, 7% strand (DSSP).

Ligands and binding sites

• F4W · 3-(12-oxidanylidene-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl)propanoic acid · ligand · chains C

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

Pockets

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

Interfaces

1 interface between chains.

• A–C · 1705 Ų buried · 27 hydrogen bonds · protein-protein

Compared structures

• 6GNN · Exoenzyme T from Pseudomonas aeruginosa in complex with human 14-3-3 protein beta… · the same entry in another collection · chain A against A, TM-score 1.00
• P31946 · AlphaFold monomer V2.0 prediction for 14-3-3 protein BETA/ALPHA (P31946) · a predicted model of the same protein · chain A against A, TM-score 0.97
• Q9I788 · AlphaFold monomer V2.0 prediction for exoenzyme T (Q9I788) · a predicted model of the same protein · chain C against A, TM-score 0.96

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt P31946
• Every structure of UniProt Q9I788
• Elsewhere: RCSB PDB 6GNN · PDBe 6GNN · UniProt P31946 · UniProt Q9I788