6Q8Q
Bovine Insulin under 2 kbar of argon
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-07-27 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 1.9997 |
| Spacegroup name | I 21 3 |
| Unit cell lengths | 77.559, 77.559, 77.559 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.810 - 2.000 |
| R-factor | 0.18262 |
| Rwork | 0.182 |
| R-free | 0.19900 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3bn3 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.774 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | FFT |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.000 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.088 | 0.302 |
| Rmeas | 0.081 | 0.218 |
| Rpim | 0.016 | 0.087 |
| Number of reflections | 5259 | 673 |
| <I/σ(I)> | 31.3 | 7.8 |
| Completeness [%] | 97.8 | 85.4 |
| Redundancy | 30.4 | 11.6 |
| CC(1/2) | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | PROTEIN DROP: 10 MG/ML. RESERVOIR: 1.2 M TMAO + 0.1 M SODIUM MALATE, PH 5.5 |
