1U5V
Structure of CitE complexed with triphosphate group of ATP form Mycobacterium tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Detector technology | CCD |
| Collection date | 2003-04-13 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.04 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 91.214, 91.214, 220.233 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.610 - 1.850 |
| R-factor | 0.212 |
| Rwork | 0.212 |
| R-free | 0.23400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1u5h |
| RMSD bond length | 0.030 |
| RMSD bond angle | 2.200 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | EPMR |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 30000 | |
| Completeness [%] | 99.7 | 100 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.4 | 300 | sodium formate, DMSO, pH 8.4, VAPOR DIFFUSION, HANGING DROP, temperature 300K |
