5JQQ
Crystal structure of glucosyl-3-phosphoglycerate synthase from Mycobacterium tuberculosis - apo form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-07-22 |
Detector | NOIR-1 |
Wavelength(s) | 1.00 |
Spacegroup name | I 41 |
Unit cell lengths | 98.850, 98.850, 127.640 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.077 - 2.600 |
R-factor | 0.2101 |
Rwork | 0.209 |
R-free | 0.23230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ckj |
RMSD bond length | 0.007 |
RMSD bond angle | 1.153 |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.770 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.480 | |
Number of reflections | 37009 | |
<I/σ(I)> | 9.1 | 3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7 | 6.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 1 mM MgCl2, 100 mM sodium cacodylate pH 6.5, 200 mM trisodium citrate, 30%(v/v) 2-propanol, VAPOR DIFFUSION, HANGING DROP, temperature 289K |