7LB9
Pseudomonas fluorescens G150T isocyanide hydratase (G150T-3) at 274K, Refmac5-refined
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 274 |
| Detector technology | PIXEL |
| Collection date | 2018-11-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.775 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 56.295, 59.716, 69.505 |
| Unit cell angles | 90.00, 110.88, 90.00 |
Refinement procedure
| Resolution | 35.222 - 1.101 |
| Rwork | 0.127 |
| R-free | 0.14060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6ni4 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.466 |
| Data reduction software | autoXDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.222 | 1.120 |
| High resolution limit [Å] | 1.101 | 1.101 |
| Rmeas | 0.057 | 1.839 |
| Number of reflections | 82868 | 3983 |
| <I/σ(I)> | 11.8 | 1 |
| Completeness [%] | 95.7 | 93.4 |
| Redundancy | 3.6 | 3.5 |
| CC(1/2) | 0.998 | 0.334 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.6 | 298 | 25% PEG 3350, 200 MM MAGNESIUM CHLORIDE, 100MM TRIS-HCL, PH 8.6, 2 MM Dithiothreitol |
