2P4G
CRYSTAL STRUCTURE OF A PYRIMIDINE REDUCTASE-LIKE PROTEIN (DIP1392) FROM CORYNEBACTERIUM DIPHTHERIAE NCTC AT 2.30 A RESOLUTION
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.3 |
Synchrotron site | ALS |
Beamline | 5.0.3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-09-22 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.00000 |
Spacegroup name | P 64 |
Unit cell lengths | 113.510, 113.510, 55.940 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.273 - 2.300 |
R-factor | 0.175 |
Rwork | 0.173 |
R-free | 0.22500 |
Structure solution method | MAD |
RMSD bond length | 0.013 |
RMSD bond angle | 1.449 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 28.273 | 28.300 | 2.380 |
High resolution limit [Å] | 2.300 | 4.930 | 2.300 |
Rmerge | 0.052 | 0.021 | 0.410 |
Number of reflections | 18260 | ||
<I/σ(I)> | 11.61 | 30.1 | 1.76 |
Completeness [%] | 97.3 | 97.4 | 92.9 |
Redundancy | 3.66 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | NANODROP, 0.2M Potassium nitrate, 20.0% PEG 3350, VAPOR DIFFUSION, SITTING DROP, temperature 277K | |
2 | VAPOR DIFFUSION, SITTING DROP | 6.9 | 277 | NANODROP, 0.2M Potassium nitrate, 20.0% PEG 3350, No Buffer pH 6.9, VAPOR DIFFUSION, SITTING DROP, temperature 277K |