2ZZ6
Covalent complex of orotidine monophosphate decarboxylase from M. thermoautotrophicum with 6-azido-UMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 14-BM-D |
Synchrotron site | APS |
Beamline | 14-BM-D |
Detector technology | CCD |
Collection date | 2004-03-05 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 57.931, 73.692, 59.147 |
Unit cell angles | 90.00, 119.31, 90.00 |
Refinement procedure
Resolution | 27.440 - 1.660 |
Rwork | 0.162 |
R-free | 0.18700 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1x1z |
RMSD bond length | 0.013 |
RMSD bond angle | 1.600 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 1.690 |
High resolution limit [Å] | 1.660 | 1.660 |
Rmerge | 0.060 | |
Number of reflections | 50234 | |
<I/σ(I)> | 22.6 | 4.5 |
Completeness [%] | 98.3 | 97 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 298 | 1.2-1.36M Sodium Citrate, 5% dioxiane, pH 6.0-8.5, VAPOR DIFFUSION, temperature 298K |