5UQK
Clostridium difficile toxin A (TcdA) glucosyltransferase domain in complex with U2F
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-07-25 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.97856 |
Spacegroup name | P 65 |
Unit cell lengths | 142.810, 142.810, 66.074 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 31.400 - 1.851 |
R-factor | 0.1825 |
Rwork | 0.182 |
R-free | 0.20710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3srz |
RMSD bond length | 0.021 |
RMSD bond angle | 1.598 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 31.400 |
High resolution limit [Å] | 1.850 |
Number of reflections | 65449 |
<I/σ(I)> | 28.4 |
Completeness [%] | 99.9 |
Redundancy | 7.4 |
CC(1/2) | 0.597 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 294 | 0.1 M HEPES, 0.2 M L-proline, PEG 3350 10-25% |