4Y1E
SAV1875-C105D
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-22 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 0.97960 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 82.055, 93.946, 42.843 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.650 - 1.800 |
| R-factor | 0.18627 |
| Rwork | 0.185 |
| R-free | 0.21765 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | SAV1875 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.320 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 40.000 | 40.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
| Rmerge | 0.085 | 0.045 | 0.395 |
| Rmeas | 0.088 | 0.047 | 0.410 |
| Rpim | 0.024 | 0.013 | 0.109 |
| Total number of observations | 422814 | ||
| Number of reflections | 31130 | ||
| <I/σ(I)> | 14.9 | ||
| Completeness [%] | 99.0 | 97.1 | 98.2 |
| Redundancy | 13.6 | 13.1 | 13.9 |
| CC(1/2) | 0.999 | 0.966 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | PPG400, Bis-Tris |
