9U3B
Monomeric sarcosine oxidase from Bacillus sp. (SoxB) complexed with L-Thioproline
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-02-07 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.876, 69.401, 73.028 |
| Unit cell angles | 90.00, 93.72, 90.00 |
Refinement procedure
| Resolution | 40.505 - 1.300 |
| Rwork | 0.153 |
| R-free | 0.17530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1el5 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.921 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.240 | 1.320 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.062 | 0.505 |
| Number of reflections | 165675 | 7948 |
| <I/σ(I)> | 6.8 | 1.8 |
| Completeness [%] | 93.2 | |
| Redundancy | 2.1 | |
| CC(1/2) | 0.993 | 0.651 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.5 M Ammonium sulfate, 100 mM Tris-HCl buffer pH8.5 |
