3DOE
Complex of ARL2 and BART, Crystal Form 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2007-12-07 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.5596 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 57.827, 44.081, 66.495 |
Unit cell angles | 90.00, 111.46, 90.00 |
Refinement procedure
Resolution | 35.900 - 2.250 |
R-factor | 0.23168 |
Rwork | 0.230 |
R-free | 0.26123 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ksg |
RMSD bond length | 0.008 |
RMSD bond angle | 1.327 |
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 | 2.330 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.065 | 0.216 |
Number of reflections | 14727 | |
<I/σ(I)> | 27.9 | 4 |
Completeness [%] | 97.7 | 83.7 |
Redundancy | 6.6 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 277 | 0.1M bicine, 10% PEG 6000, 20mM hexammine cobalt (III) chloride, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |