1CJM
HUMAN SULT1A3 WITH SULFATE BOUND
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL7-1 |
Synchrotron site | SSRL |
Beamline | BL7-1 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1998-03 |
Detector | MARRESEARCH |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 56.400, 56.400, 191.100 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 100.000 - 2.400 |
R-factor | 0.276 * |
Rwork | 0.276 |
R-free | 0.28800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1aqu |
RMSD bond length | 0.005 |
RMSD bond angle | 1.100 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | X-PLOR |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.430 |
High resolution limit [Å] | 2.350 | 2.350 |
Rmerge | 0.070 * | 0.330 * |
Total number of observations | 63776 * | |
Number of reflections | 15080 | |
<I/σ(I)> | 14.3 | 2.7 |
Completeness [%] | 97.0 | 86.8 * |
Redundancy | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 6.8 * | 20 * | 0.5 M LITHIUM SULFATE AND 5-7% POLYETHYLENE GLYCOL 8000, pH 7.0 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | sodium phosphate | 5 (mM) | |
2 | 1 | drop | dithiothreitol | 1 (mM) | |
3 | 1 | drop | protein | 15-20 (mg/ml) | |
4 | 1 | reservoir | lithium sulfate | 0.5 (M) | |
5 | 1 | reservoir | PEG8000 | 5-7 (%(w/v)) |