3NB2
Crystal structure of E. coli O157:H7 effector protein NleL
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-D |
| Synchrotron site | APS |
| Beamline | 23-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-28 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.07223 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 177.013, 124.203, 154.900 |
| Unit cell angles | 90.00, 107.60, 90.00 |
Refinement procedure
| Resolution | 44.738 - 2.100 |
| R-factor | 0.186 |
| Rwork | 0.184 |
| R-free | 0.23140 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3naw |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.020 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 185647 | |
| <I/σ(I)> | 22.1 | 2.6 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1M Mes, 1.6M LiSO4, 16% Glyerol, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
