3K0Y
Crystal structure of Putative TOXIN related protein (YP_001303978.1) from Parabacteroides distasonis ATCC 8503 at 2.16 A resolution
Experimental procedure
Experimental method | MAD |
Detector technology | CCD |
Collection date | 2009-07-31 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 71.722, 71.722, 102.566 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.559 - 2.160 |
R-factor | 0.205 |
Rwork | 0.203 |
R-free | 0.23500 |
Structure solution method | MAD |
RMSD bond length | 0.018 |
RMSD bond angle | 1.596 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHARP |
Refinement software | REFMAC (5.5.0053) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 39.559 | 39.559 | 2.240 |
High resolution limit [Å] | 2.160 | 4.640 | 2.160 |
Rmerge | 0.032 | 0.017 | 0.688 |
Number of reflections | 16892 | 3156 | 3289 |
<I/σ(I)> | 19.28 | 54.9 | 1.8 |
Completeness [%] | 99.4 | 98.3 | 99.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.79 | 277 | 5.0000% polyethylene glycol 3000, 44.0000% polyethylene glycol 400, 0.1M MES pH 5.79, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 277K, VAPOR DIFFUSION, SITTING DROP |
1 | VAPOR DIFFUSION, SITTING DROP | 5.79 | 277 | 5.0000% polyethylene glycol 3000, 44.0000% polyethylene glycol 400, 0.1M MES pH 5.79, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 277K, VAPOR DIFFUSION, SITTING DROP |
1 | VAPOR DIFFUSION, SITTING DROP | 5.79 | 277 | 5.0000% polyethylene glycol 3000, 44.0000% polyethylene glycol 400, 0.1M MES pH 5.79, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 277K, VAPOR DIFFUSION, SITTING DROP |