› 5tlq

Solution NMR

Model structure of the oxidized PaDsbA1 and 3-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine complex

Released:
DOI: 10.2210/pdb5tlq/pdb
PDB entry 5tlq coloured by chain, ensemble of 10 models, front view.
PDB entry 5tlq coloured by chain, ensemble of 10 models, side view.
PDB entry 5tlq coloured by chain, ensemble of 10 models, top view.
Source organism: Pseudomonas aeruginosa PAO1
Primary publication:
Fragment library screening identifies hits that bind to the non-catalytic surface of Pseudomonas aeruginosa DsbA1.
Mohanty B, Rimmer K, McMahon RM, Headey SJ, Vazirani M, Shouldice SR, Coinçon M, Tay S, Morton CJ, Simpson JS, Martin JL, Scanlon MJ
OpenAccess logo PLoS One 12 e0173436 (2017)
PMID: 28346540

Function and Biology Details

Biochemical function:
Biological process:
  • not assigned
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-142993 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Thiol:disulfide interchange protein DsbA Chain: A
Molecule details ›
Chain: A
Length: 190 amino acids
Theoretical weight: 21.15 KDa
Source organism: Pseudomonas aeruginosa PAO1
Expression system: Escherichia coli K-12
UniProt:
  • Canonical: P0C2B2 (Residues: 23-211; Coverage: 100%)
Gene names: PA5489, dsbA
Sequence domains: DSBA-like thioredoxin domain
Structure domains: Glutaredoxin

Ligands and Environments

1 bound ligand:
Ligand 1YO 1 x 1YO
No modified residues

Experiments and Validation Details

Entry percentile scores
Chemical shift assignment: 17%
Refinement method: simulated annealing
Expression system: Escherichia coli K-12

Quick links

Citations

3 review citations

Disulfide bond formation in prokaryotes.
Landeta et al. (2018)
2 more