3WLA
Crystal Structure of sOPH Native
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-07-13 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1 |
Spacegroup name | P 1 |
Unit cell lengths | 58.340, 75.742, 75.980 |
Unit cell angles | 74.04, 88.67, 74.01 |
Refinement procedure
Resolution | 25.000 - 1.900 |
R-factor | 0.195 |
Rwork | 0.193 |
R-free | 0.23900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3wl5 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.840 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNS (1.21) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.056 | 0.510 |
Number of reflections | 92945 | |
<I/σ(I)> | 26.2 | 2.9 |
Completeness [%] | 97.8 | 96.5 |
Redundancy | 3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 0.2M Li2SO4, 0.1 M Bis-Tris pH 6.5, 3% v/v Polyethylene Glycol 500, 6% v/v Polyethylene Glycol 600, 25% w/v Polyethylene Glycol 3350, VAPOR DIFFUSION, SITTING DROP, temperature 295K |