3TBM
Crystal structure of a type 4 CDGSH iron-sulfur protein.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-10-28 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 73.566, 54.434, 43.517 |
| Unit cell angles | 90.00, 113.78, 90.00 |
Refinement procedure
| Resolution | 22.470 - 1.797 |
| R-factor | 0.2073 |
| Rwork | 0.205 |
| R-free | 0.25070 |
| Structure solution method | SAD, MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.645 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.830 |
| High resolution limit [Å] | 1.797 | 1.800 |
| Rmerge | 0.117 | 0.150 |
| Number of reflections | 13780 | |
| <I/σ(I)> | 12.9 | 9.05 |
| Completeness [%] | 93.9 | 80.9 |
| Redundancy | 4.3 | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 277 | 0.5% PEG 5000, 0.9M potassium sodium tartrate, 100mM Tris-HCl, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 277.0K |
