› 6u0q

X-ray diffraction
1.75Å resolution

Transthyretin in complex with (E)-5,5'-(ethene-1,2-diyl)bis(1,1-dihydroxy-3-oxo-1,3-dihydrobenzo[c][1,2]oxaborol-1-uide)

Released:
DOI: 10.2210/pdb6u0q/pdb
PDB entry 6u0q coloured by chain, front view.
PDB entry 6u0q coloured by chain, side view.
PDB entry 6u0q coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Boronic acid with high oxidative stability and utility in biological contexts.
Graham BJ, Windsor IW, Gold B, Raines RT
Proc Natl Acad Sci U S A 118 (2021)
PMID: 33653951

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
homo tetramer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-136168 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Transthyretin Chains: A, B
Molecule details ›
Chains: A, B
Length: 128 amino acids
Theoretical weight: 13.91 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: P02766 (Residues: 21-147; Coverage: 100%)
Gene names: PALB, TTR
Sequence domains: HIUase/Transthyretin family

Ligands and Environments

1 bound ligand:
Ligand S2B 2 x S2B
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: BRUKER IMUS MICROFOCUS
Spacegroup: P21212
Unit cell:
a: 43.09Å b: 85.84Å c: 64.25Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.181 0.178 0.222
Expression system: Escherichia coli BL21(DE3)

Quick links

Citations

2 review citations

Emergent Organoboron Acid Catalysts.
Graham et al. (2022)
1 more

1 mention without citation

Boronic acid with high oxidative stability and utility in biological contexts.
Graham et al. (2021)