4HJB
GCN4pLI derivative with alpha/beta/cyclic-gamma amino acid substitution pattern
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-04-27 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97872 |
| Spacegroup name | P 1 2 1 |
| Unit cell lengths | 34.190, 46.290, 34.880 |
| Unit cell angles | 90.00, 91.27, 90.00 |
Refinement procedure
| Resolution | 46.290 - 1.250 |
| R-factor | 0.1419 |
| Rwork | 0.139 |
| R-free | 0.19140 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gcl |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.890 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0009) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.300 | 1.280 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Number of reflections | 27036 | |
| <I/σ(I)> | 28.84 | 4.05 |
| Completeness [%] | 89.1 | 47.5 |
| Redundancy | 11.34 | 1.79 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 298 | Precipitant solution contained 0.2 M NaCl, 0.1 M NaOAc, 30% w/v MPD, combined 1+1 uL with peptide stock at 10 mg/mL, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
