4WML
Crystal structure of Saccharomyces cerevisiae OMP synthase in complex with PRP(CH2)P
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-3 |
| Synchrotron site | MAX II |
| Beamline | I911-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-15 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 61.560, 61.560, 132.490 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.000 - 1.730 |
| R-factor | 0.21335 |
| Rwork | 0.211 |
| R-free | 0.25017 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pry |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.984 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.140 | 1.770 |
| High resolution limit [Å] | 1.730 | 1.730 |
| Number of reflections | 26807 | |
| <I/σ(I)> | 28.63 | 1.45 |
| Completeness [%] | 97.4 | 100 |
| Redundancy | 13.5 | 10.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 295 | 0.1 M NaHEPES pH 7.5, 10 % Isopropanol, 20 % PEG 4000 |
