Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-03-09 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 148.975, 148.975, 154.973 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 129.020 - 2.300 |
R-factor | 0.19934 |
Rwork | 0.198 |
R-free | 0.22163 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2bo7 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.496 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 67.000 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.100 | 0.370 |
Number of reflections | 83970 | |
<I/σ(I)> | 7.6 | 2.4 |
Completeness [%] | 99.7 | 96.8 |
Redundancy | 2.6 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 0.3 M SODIUM D-LACTATE, 0.1 M SODIUM ACETATE TRIHYDRATE, PH 4.6, 40% (V/V) 2-METHYL-1, 3-PROPANEDIOL |