Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 77 |
Detector technology | IMAGE PLATE |
Collection date | 2006-07-24 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 0.97900 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.300, 91.300, 73.100 |
Unit cell angles | 90.00, 112.60, 90.00 |
Refinement procedure
Resolution | 19.760 - 1.600 |
R-factor | 0.18875 |
Rwork | 0.188 |
R-free | 0.21080 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dy6 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.255 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.760 | 1.700 |
High resolution limit [Å] | 1.600 | 1.600 |
Number of reflections | 86680 | |
<I/σ(I)> | 21.54 | 11.68 |
Completeness [%] | 96.5 | 95.2 |
Redundancy | 3.3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 291 | 20% PEG 6000, 0.1 M KSCN, 0.1 M Sodium Acetate, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K |