4TRQ
Crystal structure of Sac3/Thp1/Sem1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 125.741, 125.741, 268.367 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.608 - 3.100 |
| R-factor | 0.1962 |
| Rwork | 0.194 |
| R-free | 0.23780 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3t5v |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.271 |
| Data reduction software | XSCALE |
| Data scaling software | SCALA (3.3.16) |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 47.608 | 47.608 | 3.270 |
| High resolution limit [Å] | 3.100 | 9.800 | 3.100 |
| Rmerge | 0.024 | 0.743 | |
| Rmeas | 0.130 | ||
| Rpim | 0.060 | 0.013 | 0.385 |
| Total number of observations | 172622 | 5241 | 26095 |
| Number of reflections | 39394 | ||
| <I/σ(I)> | 10.4 | 38 | 2 |
| Completeness [%] | 99.0 | 96.2 | 99.9 |
| Redundancy | 4.4 | 3.9 | 4.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 292 | 0.5M Li2SO4, 10% PEG-8.000 |
