6TW9
HumRadA22F in complex with CAM833
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-04-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979490 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 40.376, 61.213, 87.678 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.190 - 1.520 |
R-factor | 0.1571 |
Rwork | 0.156 |
R-free | 0.17160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5j4l |
RMSD bond length | 0.011 |
RMSD bond angle | 1.160 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.4) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 61.213 | 61.213 | 1.522 |
High resolution limit [Å] | 1.517 | 7.037 | 1.517 |
Rmerge | 0.087 | 0.022 | 0.672 |
Rmeas | 0.098 | 0.025 | 0.756 |
Rpim | 0.043 | 0.011 | 0.338 |
Total number of observations | 149322 | ||
Number of reflections | 32571 | 346 | 351 |
<I/σ(I)> | 12.5 | ||
Completeness [%] | 94.6 | 84.4 | 97.5 |
Redundancy | 4.6 | 4.4 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 298 | 20% PEG8000, 0.08 M Na Cacodylate pH 6.5, 0.16M Ca acetate, 18% glycerol |