4MKM
Repeat domains 1 & 2 of Clostridium perfringens Cpe0147
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-10-17 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.95370 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.188, 63.448, 104.984 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.620 - 1.750 |
R-factor | 0.2009 |
Rwork | 0.199 |
R-free | 0.22860 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.240 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | BUSTER (2.10.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.620 | 1.840 |
High resolution limit [Å] | 1.750 | 1.750 |
Number of reflections | 33221 | |
<I/σ(I)> | 16.9 | |
Completeness [%] | 99.9 | 99.7 |
Redundancy | 14.5 | 14.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | 12.5% PEG1000, 12.5% PEG 3350, 12.5% MPD, 0.03 M MgCl2, 0.03 M CaCl2- and 0.1 M bicine/Trizma base pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |