3ZHX
Structure of Mycobacterium tuberculosis DXR in complex with a fosmidomycin analogue
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2010-02-03 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.710, 66.990, 84.610 |
| Unit cell angles | 90.00, 107.90, 90.00 |
Refinement procedure
| Resolution | 80.510 - 2.000 |
| R-factor | 0.18627 |
| Rwork | 0.184 |
| R-free | 0.23043 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.155 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0060) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.930 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.540 |
| Number of reflections | 50282 | |
| <I/σ(I)> | 9.6 | 2.3 |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
