4QIH
The structure of mycobacterial glucosyl-3-phosphoglycerate phosphatase Rv2419c complexes with VO3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-01 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.03935 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.312, 82.762, 131.319 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.008 - 2.299 |
R-factor | 0.192 |
Rwork | 0.187 |
R-free | 0.24480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4pz9 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.493 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.340 |
High resolution limit [Å] | 2.299 | 2.299 |
Rmerge | 0.055 | 0.270 |
Number of reflections | 22409 | |
<I/σ(I)> | 46 | 9 |
Completeness [%] | 96.5 | 100 |
Redundancy | 7 | 7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1M HEPES sodium pH7.5, 10% 2-propanol, 20% w/v polyethylene glycol 4000, VAPOR DIFFUSION, SITTING DROP, temperature 293K |