1UWK
The High Resolution Structure of Urocanate Hydratase from Pseudomonas putida in complex with urocanate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-02-15 |
Detector | MARRESEARCH |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 111.429, 71.618, 129.158 |
Unit cell angles | 90.00, 98.75, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.190 |
R-factor | 0.1396 |
R-free | 0.17900 |
Structure solution method | MAD |
RMSD bond length | 0.018 |
RMSD bond angle | 0.033 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SOLVE |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.210 |
High resolution limit [Å] | 1.140 | 1.140 |
Rmerge | 0.080 | 0.510 |
Number of reflections | 1453010 | |
<I/σ(I)> | 13 | 2 |
Completeness [%] | 97.0 | 90 |
Redundancy | 3.7 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.8 | 24% PEG8000, 0.1M SODIUM CACODYLATE (PH 5.8), 0.16M SODIUM ACETATE, 0.1% BETA-MERCAPTOETHANOL |