6THJ
CBDP35 Native structure
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-12-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.99988 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 332.510, 94.590, 83.190 |
Unit cell angles | 90.00, 90.40, 90.00 |
Refinement procedure
Resolution | 37.880 - 2.200 |
R-factor | 0.1983 |
Rwork | 0.196 |
R-free | 0.23840 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6s3y |
RMSD bond length | 0.009 |
RMSD bond angle | 1.602 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.880 | 2.279 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.186 | 0.996 |
Number of reflections | 130198 | 6370 |
<I/σ(I)> | 6.8 | 1.9 |
Completeness [%] | 99.6 | 99.2 |
Redundancy | 6.3 | 6.6 |
CC(1/2) | 0.993 | 0.686 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 298.5 | 4M Sodium Formate |