3OEI
Crystal structure of Mycobacterium tuberculosis RelJK (Rv3357-Rv3358-RelBE3)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-02-25 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.219, 187.512, 113.881 |
| Unit cell angles | 90.00, 94.46, 90.00 |
Refinement procedure
| Resolution | 40.506 - 2.145 |
| R-factor | 0.2058 |
| Rwork | 0.203 |
| R-free | 0.25590 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3g5o |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.040 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_403) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 100.000 | 100.000 | 2.230 |
| High resolution limit [Å] | 2.145 | 4.630 | 2.150 |
| Rmerge | 0.066 | 0.031 | 0.403 |
| Number of reflections | 86296 | ||
| <I/σ(I)> | 8.7 | ||
| Completeness [%] | 89.8 | 84.4 | 90.4 |
| Redundancy | 2.2 | 2.4 | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 277 | 20% 2-propanol, 0.1 M Sodium citrate tribasic dihydrate pH 5.6, 20% PEG 4000, vapor diffusion, hanging drop, temperature 277K |
