1QJD
Flavocytochrome C3 from Shewanella frigidimarina
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX7.2 |
| Synchrotron site | SRS |
| Beamline | PX7.2 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1996-08-20 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.488, 1.736, 1.738 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.393, 91.946, 78.288 |
| Unit cell angles | 90.00, 91.09, 90.00 |
Refinement procedure
| Resolution | 24.000 - 1.800 |
| R-factor | 0.1921 |
| R-free | 0.26660 |
| Structure solution method | MAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.022 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXL-97 |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.083 | 0.207 |
| Number of reflections | 54988 | |
| <I/σ(I)> | 13.2 | 6.29 |
| Completeness [%] | 92.5 | 94 |
| Redundancy | 7.2 | 3.46 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.4 | 4 * | Pealing, S.L., (1999) J. Struct. Biol., 127, 76. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | Tris-HCl | 50-100 (mM) | |
| 2 | 1 | reservoir | 80 (mM) | ||
| 3 | 1 | reservoir | PEG8000 | 17-20 (%) | |
| 4 | 1 | reservoir | fumarate | +-10 (mM) | |
| 5 | 1 | drop | protain | 6-10 (mg/ml) | |
| 6 | 1 | drop | Tris-HCl | 10 (mM) |
