6O9T
KirBac3.1 mutant at a resolution of 4.1 Angstroms
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-09-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 4 21 2 |
| Unit cell lengths | 103.110, 103.110, 89.270 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.110 - 4.010 |
| R-factor | 0.2472 |
| Rwork | 0.246 |
| R-free | 0.27250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xl4 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.190 |
| Data reduction software | XDS |
| Data scaling software | TRUNCATE |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.110 | 4.140 |
| High resolution limit [Å] | 3.900 | 3.900 |
| Rmeas | 0.168 | |
| Number of reflections | 4688 | 702 |
| <I/σ(I)> | 7.74 | 1 |
| Completeness [%] | 99.0 | 96.7 |
| Redundancy | 7 | 6.3 |
| CC(1/2) | 0.999 | 0.330 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 292 | 33% (v/v) PEG 400, 0.1 M MES, pH 6.5; 4% (v/v) ethylene glycol, 0.1 M NaCl |
