4CDV
Spectroscopically-validated structure of cytochrome c prime from Alcaligenes xylosoxidans, reduced by X-ray irradiation at 100K
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-03-14 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 53.281, 53.281, 180.751 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.140 - 1.170 |
R-factor | 0.14061 |
Rwork | 0.140 |
R-free | 0.15998 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yli |
RMSD bond length | 0.013 |
RMSD bond angle | 2.074 |
Data reduction software | XDS |
Data scaling software | SCALA |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.100 | 1.240 |
High resolution limit [Å] | 1.170 | 1.170 |
Rmerge | 0.050 | 0.100 |
Number of reflections | 49558 | |
<I/σ(I)> | 17.1 | 2.6 |
Completeness [%] | 95.0 | 69.7 |
Redundancy | 5.7 | 2.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | AMMONIUM SULFATE, HEPES PH 7.5 |