1YLK
Crystal Structure of Rv1284 from Mycobacterium tuberculosis in Complex with Thiocyanate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-09-20 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.934 |
| Spacegroup name | F 2 2 2 |
| Unit cell lengths | 100.164, 154.074, 156.943 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.260 - 2.000 |
| R-factor | 0.18314 |
| Rwork | 0.181 |
| R-free | 0.22645 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g5c |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.305 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.300 | 2.020 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.085 | 0.434 |
| Number of reflections | 38625 | |
| <I/σ(I)> | 20.3 | 6.3 |
| Completeness [%] | 94.6 | 93.7 |
| Redundancy | 7.4 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | sodium thiocyanate, polyethylene glycol 2000, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
