2WZT
Crystal structure of a mycobacterium aldo-keto reductase in its apo and liganded form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-10-01 |
| Detector | RIGAKE |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 43.543, 103.677, 112.051 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.900 |
| R-factor | 0.17005 |
| Rwork | 0.168 |
| R-free | 0.20941 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1vbj |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.348 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.300 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.070 | 0.330 |
| Number of reflections | 40896 | |
| <I/σ(I)> | 9.3 | 2.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 4.4 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.1 | 20% PEG 0.2M CACL2 0.1M NA CACODYLATE PH 5.1 |
