8IBI
Inactive mutant of CtPL-H210S/F214I
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | LIQUID ANODE |
Source details | BRUKER METALJET |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-08-14 |
Detector | Bruker PHOTON III |
Wavelength(s) | 1.34138 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 65.316, 153.881, 52.996 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.320 - 2.140 |
R-factor | 0.17166 |
Rwork | 0.169 |
R-free | 0.22073 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7cwq |
RMSD bond length | 0.009 |
RMSD bond angle | 1.610 |
Data reduction software | SAINT |
Data scaling software | SAINT |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.320 | 2.170 |
High resolution limit [Å] | 2.140 | 2.140 |
Rmerge | 0.116 | 0.368 |
Number of reflections | 30315 | 1224 |
<I/σ(I)> | 12.52 | 3.79 |
Completeness [%] | 99.9 | |
Redundancy | 9.32 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 20% PEG 2000 MME, 0.2 M ammonium citrate tribasic pH7.0, 0.1 M imidazole pH7.0 |