3LIB
Crystal Structure of the extracellular domain of the putative histidine kinase mmHK1S-Z3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Wavelength(s) | 0.96788 |
| Spacegroup name | P 65 |
| Unit cell lengths | 129.524, 129.524, 404.729 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.720 - 2.990 |
| R-factor | 0.20095 |
| Rwork | 0.197 |
| R-free | 0.27211 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.698 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (1.3.1) |
| Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 3.110 |
| High resolution limit [Å] | 3.000 | 6.460 | 3.000 |
| Rmerge | 0.080 | 0.054 | 0.431 |
| Number of reflections | 76489 | ||
| <I/σ(I)> | 12.9 | ||
| Completeness [%] | 99.5 | 97.4 | 99.4 |
| Redundancy | 4.3 | 4.4 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.7 | 293 | 2M Na/K phosphate pH6.7, 0.2M NaCl, vapor diffusion, temperature 293K |
