3EXQ
Crystal structure of a NUDIX family hydrolase from Lactobacillus brevis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12C |
Synchrotron site | NSLS |
Beamline | X12C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-09-10 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 66.762, 82.477, 36.101 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.090 - 2.000 |
R-factor | 0.218 |
Rwork | 0.218 |
R-free | 0.25000 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.400 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.100 | 2.050 |
High resolution limit [Å] | 2.000 | 1.980 |
Rmerge | 0.079 | 0.226 |
Number of reflections | 14576 | |
<I/σ(I)> | 16.9 | 3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13 | 12.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 0.1M Sodium chloride, 0.1M HEPES, 1.6M Ammonium sulfate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |