4MX2
Crystal Structure of adenylosuccinate lyase from Leishmania donovani
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-06-22 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 124.015, 194.697, 147.507 |
Unit cell angles | 90.00, 91.31, 90.00 |
Refinement procedure
Resolution | 34.980 - 1.900 |
R-factor | 0.2195 |
Rwork | 0.218 |
R-free | 0.25340 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 0.960 |
Data scaling software | XSCALE |
Phasing software | BALBES |
Refinement software | BUSTER-TNT (BUSTER 2.10.0) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.990 | |
High resolution limit [Å] | 1.880 | 5.600 | 1.880 |
Rmerge | 0.125 | 0.079 | 0.622 |
Number of reflections | 269966 | 10728 | 41123 |
<I/σ(I)> | 5.88 | 12.14 | 1.69 |
Completeness [%] | 95.1 | 98.7 | 89.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 25 % PEG 3350, 0.2 M LiSO4, 0.1 M BisTris pH 6.5, AMP, VAPOR DIFFUSION, SITTING DROP, temperature 293K |