5QUG
HumRadA1.2 soaked with napht-2,3-diol overnight at 1 mM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-02-16 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9794 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 69.044, 72.803, 40.333 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.333 - 1.480 |
R-factor | 0.1687 |
Rwork | 0.167 |
R-free | 0.19890 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.333 | 40.333 | 1.570 |
High resolution limit [Å] | 1.480 | 4.410 | 1.480 |
Rmerge | 0.104 | 0.036 | 0.964 |
Rmeas | 0.113 | 0.039 | 1.038 |
Total number of observations | 250580 | ||
Number of reflections | 34721 | 1448 | 5499 |
<I/σ(I)> | 14.21 | 43.13 | 2.2 |
Completeness [%] | 99.9 | 99.8 | 99.1 |
Redundancy | 7.217 | 6.642 | 7.138 |
CC(1/2) | 0.999 | 0.999 | 0.736 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 50 mM Na/K phospate, 5% PEG1000H |