2XCE
Structure of YncF in complex with dUpNHpp
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-03-07 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 99.116, 99.345, 99.252 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 1.850 |
R-factor | 0.153 |
Rwork | 0.151 |
R-free | 0.18700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xcd |
RMSD bond length | 0.024 |
RMSD bond angle | 2.007 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.080 | 1.950 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.010 | 0.940 |
Number of reflections | 84193 | |
<I/σ(I)> | 15.6 | 2.4 |
Completeness [%] | 99.9 | 100 |
Redundancy | 9.4 | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 0.2M CACL2, 16% PEG 6K, 0.1M HEPES PH7 |