Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-08-03 |
Detector | CUSTOM-MADE |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 162.660, 178.020, 321.140 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.870 - 4.400 |
R-factor | 0.229 |
Rwork | 0.229 |
R-free | 0.28600 |
Structure solution method | WITH MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.370 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.900 | 4.670 |
High resolution limit [Å] | 4.400 | 4.400 |
Number of reflections | 28110 | |
<I/σ(I)> | 10.1 | |
Completeness [%] | 91.0 | |
Redundancy | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | PEG 3350, HEPES, NAF, PH 7.0, VAPOR DIFFUSION, HANGING DROP, pH 7.00, temperature 298K |