6JZZ
The crystal structure of AAR-C294S in complex with ADO.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-11-29 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 66.527, 72.335, 137.196 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.655 - 3.011 |
R-factor | 0.2129 |
Rwork | 0.207 |
R-free | 0.26850 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4rc8 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.322 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.660 | 3.120 |
High resolution limit [Å] | 3.010 | 3.010 |
Rmerge | 0.089 | |
Rpim | 0.030 | 0.400 |
Number of reflections | 13663 | 1332 |
<I/σ(I)> | 27.4 | |
Completeness [%] | 99.9 | |
Redundancy | 14 | |
CC(1/2) | 0.860 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 298 | 0.1M HEPES, pH 7.5, 20% PEG 8000 |