3H41
CRYSTAL STRUCTURE OF A NLPC/P60 FAMILY PROTEIN (BCE_2878) FROM BACILLUS CEREUS ATCC 10987 AT 1.79 A RESOLUTION
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-27 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.97860,0.91837,0.97985 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 95.205, 59.373, 61.333 |
Unit cell angles | 90.00, 103.27, 90.00 |
Refinement procedure
Resolution | 41.523 - 1.790 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.19700 |
Structure solution method | MAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.499 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELX |
Refinement software | REFMAC (5.5.0053) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 41.523 | 41.523 | 1.840 |
High resolution limit [Å] | 1.790 | 3.830 | 1.780 |
Rmerge | 0.111 | 0.042 | 0.771 |
Number of reflections | 31085 | 3253 | 2578 |
<I/σ(I)> | 9.59 | 26.5 | 1.8 |
Completeness [%] | 97.1 | 98.4 | 86.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.2 | 277 | 0.2000M NaCl, 50.0000% PEG-200, 0.1M Phosphate Citrate pH 4.2, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K |