6Q12
Structure of pro-Esp mutant- S66V
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-11-10 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.650, 61.110, 75.470 |
Unit cell angles | 90.00, 94.70, 90.00 |
Refinement procedure
Resolution | 42.510 - 2.200 |
R-factor | 0.1762 |
Rwork | 0.173 |
R-free | 0.23360 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6pym |
RMSD bond length | 0.007 |
RMSD bond angle | 0.787 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.510 | 2.270 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.069 | 0.088 |
Rmeas | 0.125 | |
Rpim | 0.057 | |
Number of reflections | 18892 | 1779 |
<I/σ(I)> | 9.7 | |
Completeness [%] | 95.0 | |
Redundancy | 1.5 | |
CC(1/2) | 0.966 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 3350, 0.225 M Ammonium Nitrate |