4XPW
Crystal structures of Leu114F mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-12 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | P 6 |
| Unit cell lengths | 83.281, 83.281, 30.959 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 24.840 - 1.170 |
| R-factor | 0.15256 |
| Rwork | 0.152 |
| R-free | 0.16459 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4xpx |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.286 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | HKL-2000 |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.840 | 1.210 |
| High resolution limit [Å] | 1.170 | 1.170 |
| Number of reflections | 39403 | |
| <I/σ(I)> | 2.6 | 2.61 |
| Completeness [%] | 99.4 | 95 |
| Redundancy | 4.2 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | PEG 400, ammonium acetate, HEPES |
