Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.6 |
Synchrotron site | SRS |
Beamline | PX9.6 |
Temperature [K] | 293 |
Detector technology | IMAGE PLATE |
Collection date | 1995-08-20 |
Detector | MARRESEARCH |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.220, 59.240, 51.310 |
Unit cell angles | 90.00, 109.80, 90.00 |
Refinement procedure
Resolution | 39.500 - 1.140 |
R-factor | 0.18 |
Rwork | 0.180 |
R-free | 0.19300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2exo |
RMSD bond length | 0.006 |
RMSD bond angle | 1.470 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (0.9) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.500 | 1.150 |
High resolution limit [Å] | 1.140 | 1.140 |
Rmerge | 0.078 | 0.238 |
Number of reflections | 80691 | |
<I/σ(I)> | 9.82 | 3.15 |
Completeness [%] | 85.2 | 78.8 |
Redundancy | 2.9 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | HANGING DROPS CONTAINING 1:1 RATIO OF 20 MG/ML PROTEIN SOLUTION AND RESERVOIR SOLUTION (12 % TO 25 % PEG 6,000)., pH 7.00 |