5VXH
Crystal structure of Xanthomonas campestris OleA E117D
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-02-17 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.02235 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 81.876, 85.409, 102.794 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.840 |
R-factor | 0.1602 |
Rwork | 0.158 |
R-free | 0.19800 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3row |
RMSD bond length | 0.027 |
RMSD bond angle | 2.448 |
Data reduction software | HKL-2000 (v705) |
Data scaling software | HKL-2000 (v705) |
Phasing software | REFMAC (5.8.0158) |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.870 |
High resolution limit [Å] | 1.840 | 4.990 | 1.840 |
Rmerge | 0.088 | 0.034 | 0.975 |
Rmeas | 0.092 | 0.037 | |
Rpim | 0.035 | 0.015 | 0.400 |
Number of reflections | 63324 | ||
<I/σ(I)> | 11.7 | ||
Completeness [%] | 100.0 | 99.5 | 100 |
Redundancy | 7.3 | 6.7 | 6.9 |
CC(1/2) | 0.999 | 0.736 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.2 | 292 | 14% PEG 8000, 100 mM potassium phosphate dibasic, 100 mM sodium citrate pH 4.2 |