4IVZ
A Y37F mutant of C.Esp1396I bound to its highest affinity operator site OM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-10-31 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.540, 146.700, 47.790 |
Unit cell angles | 90.00, 93.21, 90.00 |
Refinement procedure
Resolution | 34.630 - 3.100 |
R-factor | 0.17194 |
Rwork | 0.170 |
R-free | 0.21478 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ufd |
RMSD bond length | 0.011 |
RMSD bond angle | 1.708 |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.1.26) |
Phasing software | PHASER (2.5.1) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 146.810 | 3.310 |
High resolution limit [Å] | 3.100 | 3.100 |
Rmerge | 0.111 | 0.666 |
Number of reflections | 11810 | |
<I/σ(I)> | 12.7 | 1.8 |
Completeness [%] | 99.5 | 99.6 |
Redundancy | 3.5 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 289 | 0.1 M SPG buffer, 25 % w/v PEG 1500, 10 uM Spermidine , pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 289K |