1LN4
CRYSTAL STRUCTURE OF E. COLI YHBY
Experimental procedure
| Experimental method | MAD |
| 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 | 2001-06-28 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9611,0.9793,0.9792 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 57.324, 57.324, 70.895 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 1.500 |
| R-factor | 0.193 |
| Rwork | 0.192 |
| R-free | 0.22300 |
| Structure solution method | MAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.800 * |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | TNT (5F) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.074 | 0.139 |
| Number of reflections | 22061 * | |
| <I/σ(I)> | 4.5 | 4.5 |
| Completeness [%] | 100.0 * | 99.9 |
| Redundancy | 10.6 | 10.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 * | 298 | PEG 200, sodium chloride, tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 * | 298 | PEG 200, sodium chloride, tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | 50 (mM) | ||
| 2 | 1 | drop | Tris | 10 (mM) | pH7.0 |
| 3 | 1 | drop | EDTA | 0.1 (mM) | |
| 4 | 1 | drop | dithiothreitol | 5 (mM) | |
| 5 | 1 | drop | protein | 10 (mg/ml) | |
| 6 | 1 | reservoir | PEG200 | 45 (%(v/v)) | |
| 7 | 1 | reservoir | Tris | 100 (mM) | pH8.5 |
| 8 | 1 | reservoir | 100 (mM) |
