2REO
Crystal structure of human sulfotransferase 1C3 (Sult1C3) in complex with PAP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-09-22 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97900 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 93.230, 93.230, 146.430 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.000 - 2.651 |
| R-factor | 0.228 |
| Rwork | 0.226 |
| R-free | 0.27900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2h8k |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.352 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 40.000 | 40.000 | 2.740 |
| High resolution limit [Å] | 2.650 | 5.700 | 2.650 |
| Rmerge | 0.061 | 0.028 | 0.978 |
| Number of reflections | 11518 | ||
| <I/σ(I)> | 11.1 | ||
| Completeness [%] | 99.8 | 99.5 | 98.7 |
| Redundancy | 18.9 | 17.3 | 14.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.2M Diammonium tartrate, 0.1M MES, 18% PEG 2000, 5% Ethylene glycol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
