3DOF
Complex of ARL2 and BART, Crystal Form 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6A |
Synchrotron site | Photon Factory |
Beamline | BL-6A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2007-03-04 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 44.663, 45.165, 175.879 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.180 - 3.300 |
R-factor | 0.2553 |
Rwork | 0.253 |
R-free | 0.29443 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ksg |
RMSD bond length | 0.007 |
RMSD bond angle | 1.074 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.420 |
High resolution limit [Å] | 3.300 | 3.300 |
Rmerge | 0.161 | 0.759 |
Number of reflections | 5818 | |
<I/σ(I)> | 11.4 | 2.4 |
Completeness [%] | 99.4 | 97.3 |
Redundancy | 5.3 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.9 | 293 | 0.2M MgCl2, 20% PEG 3350, pH 5.9, VAPOR DIFFUSION, HANGING DROP, temperature 293K |