8TT0
Pseudomonas fluorescens isocyanide hydratase pH=4.2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.886 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 57.037, 40.598, 83.283 |
Unit cell angles | 90.00, 104.28, 90.00 |
Refinement procedure
Resolution | 40.350 - 1.500 |
R-factor | 0.1697 |
Rwork | 0.168 |
R-free | 0.19600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.771 |
Data reduction software | autoXDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.350 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmeas | 0.107 | 2.150 |
Number of reflections | 58834 | 2890 |
<I/σ(I)> | 9.5 | 0.9 |
Completeness [%] | 98.9 | 99.2 |
Redundancy | 5.5 | 5.1 |
CC(1/2) | 0.999 | 0.404 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.2 | 298 | 23% PEG 3350, 200 mM MgCl2, 2 mM DTT, 100mM sodium acetate pH=4.2 |