1Q9I
The A251C:S430C double mutant of flavocytochrome c3 from Shewanella frigidimarina
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.2 |
Synchrotron site | SRS |
Beamline | PX14.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-05-22 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9750 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.290, 91.885, 78.310 |
Unit cell angles | 90.00, 91.50, 90.00 |
Refinement procedure
Resolution | 24.000 - 1.600 |
R-factor | 0.15733 |
Rwork | 0.155 |
R-free | 0.19711 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | pdb id 1qjd |
RMSD bond length | 0.014 |
RMSD bond angle | 1.489 |
Data reduction software | DENZO |
Data scaling software | CCP4 ((TRUNCATE)) |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.058 | 0.345 |
Number of reflections | 77814 | |
<I/σ(I)> | 14.31 | 2.34 |
Completeness [%] | 92.2 | 95.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | PEG 8000, TrisHCl, NaCl, fumarate, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |