7STU
Crystal structure of sulfatase from Pedobacter yulinensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 295 |
| Detector technology | PIXEL |
| Collection date | 2021-06-29 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 83.286, 83.286, 115.793 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.217 - 2.230 |
| Rwork | 0.174 |
| R-free | 0.22520 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7stt |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.382 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.270 |
| High resolution limit [Å] | 2.230 | 2.230 |
| Rmerge | 0.128 | 0.907 |
| Rmeas | 0.172 | 0.858 |
| Rpim | 0.057 | 0.339 |
| Number of reflections | 23149 | 1144 |
| <I/σ(I)> | 15.14 | 2 |
| Completeness [%] | 99.2 | 99.6 |
| Redundancy | 9.1 | 6.2 |
| CC(1/2) | 0.997 | 0.738 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.15 M potassium bromide, 30% w/v polyethylene glycol monomethyl ether 2000 |
