6XJ9
Structure of PfGH50B
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-05-23 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97932 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.240, 76.260, 269.860 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.670 - 2.000 |
| R-factor | 0.2267 |
| Rwork | 0.224 |
| R-free | 0.26920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4bq2 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.994 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.980 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.058 | 0.525 |
| Rmeas | 0.068 | 0.647 |
| Number of reflections | 99945 | 3724 |
| <I/σ(I)> | 18.3 | 2.6 |
| Completeness [%] | 97.1 | 74.9 |
| Redundancy | 6.7 | 4.7 |
| CC(1/2) | 0.999 | 0.723 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 20% PEG 3350, 0.2M CaCl2, 0.1M MES |
