6BCE
Wild-type I-LtrI bound to cognate substrate (pre-cleavage complex)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-10 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.9798 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 115.261, 42.752, 103.380 |
| Unit cell angles | 90.00, 109.22, 90.00 |
Refinement procedure
| Resolution | 38.503 - 1.750 |
| R-factor | 0.2023 |
| Rwork | 0.201 |
| R-free | 0.22520 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3r7p |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.136 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.020 | 1.786 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.062 | 0.605 |
| Number of reflections | 48184 | |
| <I/σ(I)> | 8 | 2 |
| Completeness [%] | 99.5 | 99.2 |
| Redundancy | 3 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.14 M CHES pH 9.5 0.2M NaCl 10% W/V PEG 8000 |
