7YKP
Crystal structure of a novel alpha/beta hydrolase from thermomonospora curvata with glycerol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-11-26 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 45.630, 71.580, 143.210 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.310 - 1.180 |
| R-factor | 0.1584 |
| Rwork | 0.158 |
| R-free | 0.16830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1jfr |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.250 |
| High resolution limit [Å] | 1.180 | 1.180 |
| Rmerge | 0.073 | |
| Rmeas | 0.077 | |
| Number of reflections | 74712 | 11136 |
| <I/σ(I)> | 15.34 | 3.13 |
| Completeness [%] | 95.3 | 89.36 |
| Redundancy | 8.461 | 7.889 |
| CC(1/2) | 0.999 | 0.910 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 295 | MPD, PEG 1500, NaAc |
