7EWC
Mycobacterium tuberculosis HigA2 (Form I)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 5C (4A) |
Synchrotron site | PAL/PLS |
Beamline | 5C (4A) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-07-03 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.98 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 30.610, 88.955, 114.961 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.220 - 2.050 |
R-factor | 0.209 |
Rwork | 0.207 |
R-free | 0.24710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1y7y 3b7h 3kxa 2a6c |
RMSD bond length | 0.010 |
RMSD bond angle | 1.693 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.090 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.079 | |
Number of reflections | 20447 | 969 |
<I/σ(I)> | 29 | |
Completeness [%] | 99.8 | |
Redundancy | 6 | |
CC(1/2) | 0.990 | 0.984 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 11% (w/v) PEK 20000, 0.1M MES pH 6.5 |