3BQX
High resolution crystal structure of a glyoxalase-related enzyme from Fulvimarina pelagi
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-12 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.9798 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 53.930, 69.750, 83.070 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 17.070 - 1.400 |
R-factor | 0.238 |
Rwork | 0.238 |
R-free | 0.24800 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHELX |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.070 | 1.390 |
High resolution limit [Å] | 1.320 | 1.320 |
Rmerge | 0.060 | 0.861 |
Number of reflections | 37108 | |
<I/σ(I)> | 18.3 | 3.8 |
Completeness [%] | 98.8 | 92.7 |
Redundancy | 14.3 | 12.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 2.0M Ammonium sulfate, 10 mM Tris-HCl pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |