1RKY
PPLO + Xe
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-04-01 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.552 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 140.144, 66.702, 108.620 |
Unit cell angles | 90.00, 119.24, 90.00 |
Refinement procedure
Resolution | 31.470 - 1.680 |
R-factor | 0.151 |
Rwork | 0.151 |
R-free | 0.18200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PPLO 1N9E chain A |
RMSD bond length | 0.012 |
RMSD bond angle | 1.403 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.460 | 1.740 |
High resolution limit [Å] | 1.680 | 1.680 |
Rmerge | 0.090 | |
Number of reflections | 99719 | |
<I/σ(I)> | 11.9 | 2.1 |
Completeness [%] | 87.7 | 84.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 300 | 35% MPD, Imidazole pH 8.0, 200mM MgCl2, VAPOR DIFFUSION, HANGING DROP, temperature 300K. CRYSTAL EXPOSED TO XENON AT 300 PSI FOR 90 SECONDS THEN FROZEN |