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 |
