6QSM
mTFP* open conformation: I197C-Y200H-Y204H mutant for enhanced metal binding
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-05-02 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 36.958, 70.549, 74.926 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 15.000 - 1.650 |
| R-factor | 0.15274 |
| Rwork | 0.152 |
| R-free | 0.19612 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hqk |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.608 |
| Data reduction software | DENZO |
| Data scaling software | PROTEUM PLUS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.750 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.059 | 0.437 |
| Number of reflections | 24258 | |
| <I/σ(I)> | 15.1 | 2.9 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 100 mM MES, 22% PEG 3000 |
