5QUC
HumRadA1.2 soaked with napht-2,3-diol for 60 seconds at 20 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 | 69.186, 73.079, 40.466 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.466 - 1.430 |
R-factor | 0.1715 |
Rwork | 0.170 |
R-free | 0.20420 |
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] | 40.466 | 40.466 | 1.510 |
High resolution limit [Å] | 1.430 | 4.260 | 1.430 |
Rmerge | 0.109 | 0.042 | 1.456 |
Rmeas | 0.118 | 0.045 | 1.575 |
Total number of observations | 274292 | ||
Number of reflections | 38774 | 1608 | 5994 |
<I/σ(I)> | 11.98 | 36.75 | 1.35 |
Completeness [%] | 99.4 | 99.4 | 96.2 |
Redundancy | 7.074 | 6.446 | 6.947 |
CC(1/2) | 0.998 | 0.998 | 0.545 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 50 mM Na/K phospate, 5% PEG1000H |