1QLW
The Atomic Resolution Structure of a Novel Bacterial Esterase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE BW7B |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | BW7B |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1997-11-15 |
| Detector | MARRESEARCH |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 134.730, 55.600, 110.200 |
| Unit cell angles | 90.00, 125.06, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.090 |
| R-factor | 0.1429 * |
| Rwork | 0.143 |
| R-free | 0.15800 |
| Structure solution method | MIR |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.027 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELX |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.000 | 1.120 |
| High resolution limit [Å] | 1.090 | 1.090 |
| Rmerge | 0.094 | 0.360 |
| Number of reflections | 274290 | |
| <I/σ(I)> | 14.5 | 2.3 |
| Completeness [%] | 99.4 | 98.2 |
| Redundancy | 3.8 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7 | Bourne, P.C., (1999) Acta Crystallogr.,Sect.D, 55, 915. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10 (mg/ml) | |
| 2 | 1 | drop | Tris-HCl | 10 (mM) | |
| 3 | 1 | drop | ammonium sulfate | saturated | |
| 4 | 1 | reservoir | ammonium sulfate | 1.5-1.6 (M) |
