6B5Y
Beta-lactamase, mixed with Ceftriaxone, 30ms time point, Shards crystal form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | SLAC LCLS BEAMLINE CXI |
Synchrotron site | SLAC LCLS |
Beamline | CXI |
Temperature [K] | 300 |
Detector technology | PIXEL |
Collection date | 2016-09-09 |
Detector | CS-PAD CXI-1 |
Wavelength(s) | 1.3 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 78.530, 96.030, 112.580 |
Unit cell angles | 90.00, 109.68, 90.00 |
Refinement procedure
Resolution | 19.340 - 2.750 |
R-factor | 0.1959 |
Rwork | 0.193 |
R-free | 0.25060 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.721 |
Data reduction software | CrystFEL |
Data scaling software | CrystFEL |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.340 | 2.810 |
High resolution limit [Å] | 2.750 | 2.750 |
Number of reflections | 38561 | |
<I/σ(I)> | 6.4 | 0.9 |
Completeness [%] | 100.0 | |
Redundancy | 526.16 | 142 |
CC(1/2) | 0.345 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 300 | Ammonium Phosphate |