4CIC
T. potens IscR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-10-27 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 41 |
Unit cell lengths | 53.585, 53.585, 118.382 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.817 - 1.600 |
R-factor | 0.2029 |
Rwork | 0.202 |
R-free | 0.22030 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.011 |
RMSD bond angle | 1.092 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.600 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.050 | 1.300 |
Number of reflections | 43750 | |
<I/σ(I)> | 14.3 | 1.6 |
Completeness [%] | 99.7 | 98.7 |
Redundancy | 4.5 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1M BIS-TRIS PH 6.5 3M NACL |