2XH6
Clostridium perfringens enterotoxin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-02-21 |
Detector | ADSC CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 210.664, 119.296, 74.834 |
Unit cell angles | 90.00, 110.50, 90.00 |
Refinement procedure
Resolution | 63.393 - 2.690 |
R-factor | 0.2131 |
Rwork | 0.211 |
R-free | 0.24920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ENTRIES 2QUO AND 2ZS6 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.532 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.000 | 2.820 |
High resolution limit [Å] | 2.700 | 2.680 |
Rmerge | 0.090 | 0.360 |
Number of reflections | 42488 | |
<I/σ(I)> | 12 | 2.2 |
Completeness [%] | 95.8 | 83.3 |
Redundancy | 2.7 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 32-40% V/V DIOXANE IN WATER |