5JNQ
MraY tunicamycin complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-02-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.976 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 92.640, 105.540, 134.960 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.190 - 2.600 |
R-factor | 0.228 |
Rwork | 0.226 |
R-free | 0.25200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4j72 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.090 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.200 | |
High resolution limit [Å] | 2.600 | 2.600 |
Number of reflections | 14664 | |
<I/σ(I)> | 8.5 | |
Completeness [%] | 99.8 | |
Redundancy | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | 15 - 23 % (v/v) PEG 400, 100 mM Hepes pH 7.5 - 8.25, 4 % (v/v) aceton |