Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.2 |
| Synchrotron site | ALS |
| Beamline | 5.0.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-10-30 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 167.076, 221.256, 193.685 |
| Unit cell angles | 90.00, 100.10, 90.00 |
Refinement procedure
| Resolution | 39.860 - 3.610 |
| R-factor | 0.315 |
| Rwork | 0.315 |
| R-free | 0.34300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1i6h |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 3.700 |
| High resolution limit [Å] | 3.600 | 3.600 |
| Rmerge | 0.139 * | 0.312 |
| Number of reflections | 73591 | |
| Completeness [%] | 92.9 | 87.1 |
| Redundancy | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, sitting drop * | 6.5 * | 298 | Gnatt, A.L., (2001) Science, 292, 1876. * |
Crystallization Reagents
| ID | crystal ID | solution ID | reagent name | concentration | details |
| 1 | 1 | 1 | PEG 6000 | ||
| 2 | 1 | 1 | ammonium sodium phosphate | ||
| 3 | 1 | 1 | DTT | ||
| 4 | 1 | 1 | H2O | ||
| 5 | 1 | 2 | PEG 6000 | ||
| 6 | 1 | 2 | ammonium sodium phosphate | ||
| 7 | 1 | 2 | DTT | ||
| 8 | 1 | 2 | H2O |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | dioxane | 50 (mM) | |
| 2 | 1 | reservoir | dithiothreitol | 10 (mM) | |
| 3 | 1 | reservoir | 390 (mM) | ||
| 4 | 1 | reservoir | PEG6000 | ||
| 5 | 1 | drop | protein | 5-8 (mg) |
