1SJW
Structure of polyketide cyclase SnoaL
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-04-14 |
Detector | ADSC QUANTUM 4r |
Wavelength(s) | 0.934 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 69.100, 72.000, 65.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.030 - 1.350 |
Rwork | 0.143 |
R-free | 0.17600 |
Structure solution method | SIRAS |
Starting model (for MR) | Built by ARP/WARP |
RMSD bond length | 0.013 |
RMSD bond angle | 1.150 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Refinement software | SHELXL |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.030 | 1.420 |
High resolution limit [Å] | 1.350 | 1.350 |
Number of reflections | 35447 | |
<I/σ(I)> | 23.3 | 3.4 |
Completeness [%] | 98.5 | 98.5 |
Redundancy | 11.3 | 8.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | PEG4000, Tris HCl, Na Acetate, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | PEG4000, Tris HCl, Na Acetate, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |