5Z1V
Crystal structure of AvrPib
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-11-23 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9776 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 28.542, 65.840, 55.634 |
| Unit cell angles | 90.00, 93.48, 90.00 |
Refinement procedure
| Resolution | 42.449 - 1.661 |
| R-factor | 0.2011 |
| Rwork | 0.197 |
| R-free | 0.24460 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.120 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AutoSol |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.450 | 1.720 |
| High resolution limit [Å] | 1.660 | 1.660 |
| Rmerge | 0.131 | |
| Number of reflections | 24125 | |
| <I/σ(I)> | 15.7 | |
| Completeness [%] | 99.3 | |
| Redundancy | 6.5 | |
| CC(1/2) | 0.994 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M sodium thiocyanate pH 6.9, 20% (w/v) PEG 3350 |
