2H8K
Human Sulfotranferase SULT1C3 in complex with PAP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-19 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.000 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 87.161, 108.717, 136.925 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 3.200 |
Rwork | 0.292 |
R-free | 0.34240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ad1 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.390 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (refmac_5.2.0019) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 3.110 |
High resolution limit [Å] | 3.000 | 6.460 | 3.000 |
Rmerge | 0.149 | 0.067 | 0.651 |
Number of reflections | 13470 | 1430 | 1182 |
<I/σ(I)> | 10.5 | ||
Completeness [%] | 98.4 | ||
Redundancy | 5.7 | 5.9 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.9 | 291 | PAP, 18% PEG-3350, 0.2M ammonium formate, BisTris, pH 6.9, vapor diffusion, sitting drop, temperature 291K |