5NJB
E. coli Microcin-processing metalloprotease TldD/E with actinonin bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-07-24 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.570, 172.880, 82.630 |
Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
Resolution | 50.870 - 1.500 |
R-factor | 0.132 |
Rwork | 0.130 |
R-free | 0.16850 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5nj5 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.390 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.12) |
Phasing software | REFMAC |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.870 | 50.870 | 1.540 |
High resolution limit [Å] | 1.500 | 6.710 | 1.500 |
Rmerge | 0.133 | 0.044 | 1.344 |
Rmeas | 0.144 | 0.048 | 1.457 |
Rpim | 0.055 | 0.018 | 0.554 |
Number of reflections | 287508 | ||
<I/σ(I)> | 10.1 | ||
Completeness [%] | 99.8 | 99.1 | 99.2 |
Redundancy | 6.8 | 7 | 6.7 |
CC(1/2) | 0.997 | 0.998 | 0.453 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | NULL |