6QI1
Time resolved structural analysis of the full turnover of an enzyme - 12312 ms
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P14 (MX2) |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2016-06-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9627 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.760, 79.610, 84.430 |
| Unit cell angles | 90.00, 102.86, 90.00 |
Refinement procedure
| Resolution | 20.048 - 1.900 |
| R-factor | 0.2143 |
| Rwork | 0.212 |
| R-free | 0.25880 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.756 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 82.320 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 42453 | |
| <I/σ(I)> | 2.1 | |
| Completeness [%] | 99.9 | |
| Redundancy | 31.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH MODE | 293 | 18-20 % (w/v)) PEG3350, 200 mM CaCl2, and 100 mM Tris-HCl pH 8.5 |
