3ZWU
Pseudomonas fluorescens PhoX in complex with vanadate, a transition state analogue
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 120 |
Collection date | 2010-02-22 |
Detector | ADSC |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.790, 71.470, 227.830 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.420 - 1.390 |
R-factor | 0.1586 |
Rwork | 0.158 |
R-free | 0.17130 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.006 |
RMSD bond angle | 0.990 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | SHELXD |
Refinement software | BUSTER (2.11.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.420 | 1.430 |
High resolution limit [Å] | 1.390 | 1.390 |
Rmerge | 0.060 | 0.640 |
Number of reflections | 223863 | |
<I/σ(I)> | 14.4 | 1.7 |
Completeness [%] | 99.7 | 100 |
Redundancy | 5.8 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 0.1 M TRIS HCL PH 8.0, 0.2 M LICL, 20% W/V PEG 6000, 100 UM NA3 VO4. |