6MBG
GphF Dehydratase P1711L variant for improved crystallization
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-22 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.033 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 53.398, 71.658, 78.122 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.080 - 1.852 |
| R-factor | 0.1801 |
| Rwork | 0.177 |
| R-free | 0.21040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.6.2) |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 44.080 | 44.080 | 1.890 |
| High resolution limit [Å] | 1.850 | 9.070 | 1.850 |
| Rmerge | 0.074 | 0.023 | 1.139 |
| Rmeas | 0.080 | 0.025 | 1.273 |
| Rpim | 0.030 | 0.010 | 0.555 |
| Total number of observations | 182544 | 1552 | 7475 |
| Number of reflections | 26083 | 270 | 1485 |
| <I/σ(I)> | 16.1 | 47.8 | 1.4 |
| Completeness [%] | 99.6 | 99.4 | 94.1 |
| Redundancy | 7 | 5.7 | 5 |
| CC(1/2) | 0.999 | 1.000 | 0.626 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.3 | 293.15 | 0.1 M trisodium citrate, 20% PEG 4000, 22% 1,4-butanediol, 0.1 mM Hepes pH 7.3 |
