6QAZ
Crystal structure of gp41-1 intein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-07-20 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97949 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 48.809, 69.986, 71.236 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.920 - 1.020 |
| R-factor | 0.12263 |
| Rwork | 0.121 |
| R-free | 0.14980 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4kl5 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 2.086 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.920 | 1.040 |
| High resolution limit [Å] | 1.020 | 1.020 |
| Rmerge | 0.038 | |
| Rpim | 0.019 | |
| Number of reflections | 57411 | |
| <I/σ(I)> | 31.5 | |
| Completeness [%] | 92.1 | |
| Redundancy | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 3.5 | 293 | citric acid, magnesium sulfate, PEG 3350 |
