3M70
Crystal Structure of TehB from Haemophilus influenzae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X4A |
Synchrotron site | NSLS |
Beamline | X4A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-01-01 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 90.488, 170.217, 55.321 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.950 |
R-factor | 0.189 |
Rwork | 0.187 |
R-free | 0.23000 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXS |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.930 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.087 | 0.931 |
Number of reflections | 33498 | |
<I/σ(I)> | 12.5 | 4.9 |
Completeness [%] | 96.6 | 74.8 |
Redundancy | 13.8 | 9.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 298 | 25% PEG3350,100mM Bis-Tris pH 6.5, 200mM Li2SO4, VAPOR DIFFUSION, HANGING DROP, temperature 298K |