2JI5
Structure of UMP kinase from Pyrococcus furiosus complexed with UTP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM16 |
Synchrotron site | ESRF |
Beamline | BM16 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-10-03 |
Detector | MARRESEARCH |
Spacegroup name | I 2 3 |
Unit cell lengths | 144.943, 144.943, 144.943 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.450 |
R-factor | 0.2094 |
Rwork | 0.209 |
R-free | 0.25380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2bmu |
RMSD bond length | 0.009 |
RMSD bond angle | 1.460 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 72.550 | 2.580 |
High resolution limit [Å] | 2.450 | 2.450 |
Rmerge | 0.090 | 0.410 |
Number of reflections | 9813 | |
<I/σ(I)> | 22.4 | 4.9 |
Completeness [%] | 100.0 | 100 |
Redundancy | 9.3 | 9.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 3.5 M SODIUM FORMATE, pH 8 |