5H4G
Structure of PIN-domain protein (VapC4 toxin) from Pyrococcus horikoshii determined at 1.77 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 300 |
| Detector technology | CCD |
| Collection date | 2011-03-14 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.780, 44.640, 52.370 |
| Unit cell angles | 90.00, 103.40, 90.00 |
Refinement procedure
| Resolution | 50.940 - 1.770 |
| R-factor | 0.17001 |
| Rwork | 0.167 |
| R-free | 0.22135 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1v96 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.899 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.940 | 1.810 |
| High resolution limit [Å] | 1.770 | 1.770 |
| Rmerge | 0.749 | |
| Number of reflections | 22115 | |
| <I/σ(I)> | 18.4 | 2.3 |
| Completeness [%] | 99.1 | 97.1 |
| Redundancy | 7.2 | 6.2 |
| CC(1/2) | 0.680 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 295 | 0.2M Sodium acetate trihydrate, 0.1M Tris-HCl, 30%(w/v) PEG 4000, 0.1M Turine |
