6KV0
Ferredoxin I from C. reinhardtii, high X-ray dose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-11-17 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1 |
Spacegroup name | P 1 |
Unit cell lengths | 25.820, 32.300, 49.930 |
Unit cell angles | 72.27, 78.09, 72.22 |
Refinement procedure
Resolution | 28.718 - 1.400 |
R-factor | 0.1757 |
Rwork | 0.175 |
R-free | 0.18740 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.234 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless (0.5.26) |
Phasing software | PHENIX |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 29.710 | 29.710 | 1.420 |
High resolution limit [Å] | 1.400 | 7.540 | 1.400 |
Rmerge | 0.101 | 0.066 | 0.439 |
Rmeas | 0.117 | 0.077 | 0.508 |
Rpim | 0.059 | 0.039 | 0.256 |
Total number of observations | 679 | 5348 | |
Number of reflections | 54425 | 185 | 1368 |
<I/σ(I)> | 8.1 | 14.4 | 2.8 |
Completeness [%] | 95.4 | 97.9 | 92.9 |
Redundancy | 3.9 | 3.7 | 3.9 |
CC(1/2) | 0.992 | 0.993 | 0.861 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 5.6 | 293 | Ammonium sulfate Sodium citrate Sodium thiocyanate Benzamidine Hydrochloride |