4WHI
Crystal structure of C-terminal domain of penicillin binding protein Rv0907
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-10-10 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.91951 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.305, 49.839, 59.345 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.170 - 1.700 |
R-factor | 0.1626 |
Rwork | 0.160 |
R-free | 0.20530 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.172 |
Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.730 |
High resolution limit [Å] | 1.700 | 4.610 | 1.700 |
Rmerge | 0.099 | 0.089 | 0.686 |
Total number of observations | 78779 | ||
Number of reflections | 11971 | ||
<I/σ(I)> | 11.5 | ||
Completeness [%] | 99.8 | 97.4 | 99.8 |
Redundancy | 6.6 | 5.9 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 297 | 10mM Magnesium Chloride 5mM Nickel Chloride 0.1M HEPES 15% PEG3350 |