6QSO
mTFP* closed conformation: I197E-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 | 2014-09-06 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.757, 84.993, 38.497 |
| Unit cell angles | 90.00, 112.56, 90.00 |
Refinement procedure
| Resolution | 15.000 - 1.800 |
| R-factor | 0.15567 |
| Rwork | 0.154 |
| R-free | 0.19778 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hqk |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.712 |
| 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 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.079 | 0.422 |
| Number of reflections | 19110 | |
| <I/σ(I)> | 15.5 | |
| Completeness [%] | 99.7 | 99.6 |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 100 mM HEPES, 22% PEG 3000 |
