2QUA
Crystal structure of LipA from Serratia marcescens
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-14 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.000, 0.780 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 115.070, 115.070, 104.434 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.270 - 1.950 |
R-factor | 0.173 |
Rwork | 0.172 |
R-free | 0.19600 |
Structure solution method | SAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.227 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHARP |
Refinement software | REFMAC (5.3.0036) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.060 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.093 | 0.730 |
Number of reflections | 51634 | |
<I/σ(I)> | 12.8 | 1.1 |
Completeness [%] | 94.5 | 73 |
Redundancy | 4.88 | 4.23 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.6 | 281 | 26% MPD, 0.1 M Na-Acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 281K, pH 4.60 |