5EVY
Salicylate hydroxylase substrate complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-01-25 |
Detector | BRUKER SMART 6500 |
Wavelength(s) | 0.9 |
Spacegroup name | P 64 |
Unit cell lengths | 142.330, 142.330, 62.350 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.320 - 2.470 |
R-factor | 0.20385 |
Rwork | 0.201 |
R-free | 0.26017 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.757 |
Data scaling software | SCALA |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.830 | 2.600 |
High resolution limit [Å] | 2.470 | 2.470 |
Rmerge | 0.105 | |
Number of reflections | 26083 | |
<I/σ(I)> | 12 | 2.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 9.6 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | ammonium sulfate, lithium sulfate, Tris-HCl |