3WTB
Crystal structure of Gox0525
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-02-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.075 |
Spacegroup name | P 1 2 1 |
Unit cell lengths | 58.061, 56.033, 263.992 |
Unit cell angles | 90.00, 93.20, 90.00 |
Refinement procedure
Resolution | 49.730 - 2.200 |
R-factor | 0.15616 |
Rwork | 0.155 |
R-free | 0.18555 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3a28 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.720 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.260 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 80342 | |
Completeness [%] | 97.0 | 77.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |