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 |