7ANH
DdhaC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2016-10-04 |
| Detector | RIGAKU SATURN 944 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 131.801, 131.801, 50.170 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 93.200 - 2.080 |
| R-factor | 0.1926 |
| Rwork | 0.190 |
| R-free | 0.23240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1bsv |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.887 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.000 | 2.140 |
| High resolution limit [Å] | 2.080 | 2.080 |
| Rmerge | 0.163 | 0.610 |
| Number of reflections | 25782 | 1861 |
| <I/σ(I)> | 11.5 | 3.3 |
| Completeness [%] | 100.0 | |
| Redundancy | 12.5 | |
| CC(1/2) | 0.900 | 0.800 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 54 % (w/v) PEG 400, 0.1 M HEPES pH 7.5, 0.08 M ammonium citrate |
