6J35
Crystal structure of ligand-free of PulA-G680L mutant from Klebsiella pneumoniae
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-04-16 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 |
| Unit cell lengths | 60.159, 80.203, 127.301 |
| Unit cell angles | 94.92, 103.01, 112.03 |
Refinement procedure
| Resolution | 38.721 - 1.839 |
| R-factor | 0.1654 |
| Rwork | 0.164 |
| R-free | 0.18950 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2fhf |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.056 |
| Data reduction software | DENZO |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.900 |
| High resolution limit [Å] | 1.839 | 1.840 |
| Rmerge | 0.047 | 0.136 |
| Rmeas | 0.060 | 0.175 |
| Rpim | 0.037 | 0.107 |
| Number of reflections | 181784 | 17267 |
| <I/σ(I)> | 19.7 | 8.8 |
| Completeness [%] | 97.5 | 93.3 |
| Redundancy | 2.7 | 2.7 |
| CC(1/2) | 0.997 | 0.968 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2M sodium acetate buffer (pH 6.0), 0.2M magnesium acetate, 20%(w/v) PEG 6000 |
