2OQH
Crystal structure of an isomerase from Streptomyces coelicolor A3(2)
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 | 2007-01-26 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.97950 |
Spacegroup name | P 4 |
Unit cell lengths | 120.336, 120.336, 126.731 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.450 - 1.980 |
R-factor | 0.205 |
Rwork | 0.205 |
R-free | 0.23100 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
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] | 50.000 | 2.010 |
High resolution limit [Å] | 1.980 | 1.980 |
Rmerge | 0.080 | 0.530 |
Number of reflections | 125276 | |
<I/σ(I)> | 8.6 | 1 |
Completeness [%] | 100.0 | 100 |
Redundancy | 14.4 | 9.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 278 | 0.1M MES, pH 6.5, 12% PEG 20000, VAPOR DIFFUSION, SITTING DROP, temperature 278K |