2UZH
Mycobacterium smegmatis 2C-methyl-D-erythritol-2,4-cyclodiphosphate synthase (IspF)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-05-20 |
Detector | MARRESEARCH |
Spacegroup name | I 4 |
Unit cell lengths | 159.121, 159.121, 54.160 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.300 - 2.200 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.20600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1gx1 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.570 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.300 | 3.110 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.080 | 0.350 |
Number of reflections | 33193 | |
<I/σ(I)> | 6 | 1.7 |
Completeness [%] | 95.4 | 76.3 |
Redundancy | 3.5 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 18% PEG 8000, 0.1 M SODIUM CACODYLATE PH 6.5, 0.2 M CALCIUM ACETATE |