5NJ5
E. coli Microcin-processing metalloprotease TldD/E with phosphate bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-08-01 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9200 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.770, 173.990, 83.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 75.290 - 1.900 |
R-factor | 0.1406 |
Rwork | 0.139 |
R-free | 0.17810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3tv9 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.376 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.12) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 75.290 | 75.290 | 1.950 |
High resolution limit [Å] | 1.900 | 8.500 | 1.900 |
Rmerge | 0.087 | 0.027 | 0.551 |
Rmeas | 0.100 | 0.031 | 0.683 |
Rpim | 0.047 | 0.014 | 0.392 |
Number of reflections | 136171 | ||
<I/σ(I)> | 12.3 | ||
Completeness [%] | 94.1 | 99.1 | 69.1 |
Redundancy | 4.2 | 4.6 | 3 |
CC(1/2) | 0.997 | 0.999 | 0.565 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | NULL |