3K9I
Crystal structure of Putative protein binding protein (NP_241345.1) from Bacillus halodurans at 2.71 A resolution
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-08-12 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97925,0.94926,0.97939 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 73.656, 73.656, 115.838 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 42.875 - 2.710 |
R-factor | 0.221 |
Rwork | 0.221 |
R-free | 0.23300 |
Structure solution method | MAD |
RMSD bond length | 0.017 |
RMSD bond angle | 1.530 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELX |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 42.875 | 42.875 | 2.810 |
High resolution limit [Å] | 2.710 | 5.800 | 2.710 |
Rmerge | 0.056 | 0.028 | 0.731 |
Number of reflections | 5493 | 645 | 530 |
<I/σ(I)> | 25.03 | 50.7 | 3.1 |
Completeness [%] | 99.8 | 99.1 | 99.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.07 | 293 | 3.5M sodium formate, 0.1M HEPES pH 7.07, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 293K |