› 2jjy

X-ray diffraction
2.9Å resolution

Crystal structure of Francisella tularensis enoyl reductase (ftFabI) with bound NAD

Released:
DOI: 10.2210/pdb2jjy/pdb
PDB entry 2jjy coloured by chain, front view.
PDB entry 2jjy coloured by chain, side view.
PDB entry 2jjy coloured by chain, top view.
Source organism: Francisella tularensis
Primary publication:
Slow-onset inhibition of the FabI enoyl reductase from francisella tularensis: residence time and in vivo activity.
Lu H, England K, am Ende C, Truglio JJ, Luckner S, Reddy BG, Marlenee NL, Knudson SE, Knudson DL, Bowen RA, Kisker C, Slayden RA, Tonge PJ
ACS Chem Biol 4 221-31 (2009)
PMID: 19206187

Function and Biology Details

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

Structure analysis Details

Assembly composition:
homo tetramer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-162778 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE Chains: A, B, C, D
Molecule details ›
Chains: A, B, C, D
Length: 268 amino acids
Theoretical weight: 28.91 KDa
Source organism: Francisella tularensis
Structure domains: NAD(P)-binding Rossmann-like Domain

Ligands and Environments

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

Experiments and Validation Details

Entry percentile scores
X-ray source: NSLS BEAMLINE X26C
Spacegroup: P212121
Unit cell:
a: 96.006Å b: 99.454Å c: 111.032Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.206 0.202 0.281

Quick links

Citations

15 review citations

Drug-target residence time: critical information for lead optimization.
Lu et al. (2010)
14 more

5 mentions without citation

Slow-onset inhibition of the FabI enoyl reductase from francisella tularensis: residence time and in vivo activity.
Lu et al. (2009)
4 more