5UKY
DHp domain of PhoR of M. tuberculosis - native data
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-08-15 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 23.250, 74.534, 44.539 |
Unit cell angles | 90.00, 96.64, 90.00 |
Refinement procedure
Resolution | 44.240 - 2.020 |
R-factor | 0.1733 |
Rwork | 0.171 |
R-free | 0.21680 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ukv |
RMSD bond length | 0.015 |
RMSD bond angle | 1.759 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.6.1) |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.050 |
High resolution limit [Å] | 2.020 | 2.020 |
Rpim | 0.043 | 0.171 |
Number of reflections | 8250 | 147 |
<I/σ(I)> | 18.2 | 2.5 |
Completeness [%] | 82.6 | 29.9 |
Redundancy | 3.6 | 1.8 |
CC(1/2) | 0.875 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 293 | PEG 200, potassium/sodium phosphate, sodium chloride |