4X08
Structure of H128N/ECP mutant in complex with sulphate anions at 1.34 Angstroms.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-10-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 92.867, 51.104, 55.601 |
Unit cell angles | 90.00, 111.09, 90.00 |
Refinement procedure
Resolution | 41.370 - 1.340 |
R-factor | 0.1855 |
Rwork | 0.184 |
R-free | 0.21790 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4a2o |
RMSD bond length | 0.007 |
RMSD bond angle | 1.054 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.370 | 1.390 |
High resolution limit [Å] | 1.340 | 1.340 |
Rmerge | 0.038 | 0.371 |
Number of reflections | 54033 | |
<I/σ(I)> | 10.9 | 2.1 |
Completeness [%] | 98.8 | 97.9 |
Redundancy | 1.82 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | CRYSTALS GREW FROM A CRYSTALLISATION CONDITION BASED ON 0.2M LITHIUM SULPHATE, 0.1M TRIS BUFFER, pH8.5 AND 15% PEG4000 |