1PJU
Unbound form of Tomato Inhibitor-II
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 105 |
| Detector technology | CCD |
| Collection date | 2002-07-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 58.688, 106.607, 81.804 |
| Unit cell angles | 90.00, 104.12, 90.00 |
Refinement procedure
| Resolution | 50.000 * - 2.150 |
| R-factor | 0.20786 |
| Rwork | 0.206 |
| R-free | 0.25000 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1oyv |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.120 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 * | 2.230 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.074 | 0.304 |
| Total number of observations | 96074 * | |
| Number of reflections | 26506 | 2619 * |
| <I/σ(I)> | 16.2 | 4.3 |
| Completeness [%] | 99.8 | 99.7 |
| Redundancy | 3.6 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | PEG 10K, Ammonium sulfate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG10000 | 7 (%(w/v)) | |
| 2 | 1 | reservoir | ammonium sulfate | 50 (mM) |
