3WHS
Crystal structure of Bacillus subtilis gamma-glutamyltranspeptidase in complex with acivicin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL38B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL38B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-09-10 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.075, 71.666, 144.357 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.040 - 1.800 |
| R-factor | 0.18411 |
| Rwork | 0.183 |
| R-free | 0.20911 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3a75 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.391 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.396 | |
| Number of reflections | 56723 | |
| Completeness [%] | 96.8 | 92.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
