7D9W
Gamma-glutamyltranspeptidase from Pseudomonas nitroreducens complexed with L-DON
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-10-26 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 |
| Unit cell lengths | 43.516, 53.846, 107.549 |
| Unit cell angles | 91.59, 100.31, 108.06 |
Refinement procedure
| Resolution | 40.560 - 1.900 |
| R-factor | 0.1569 |
| Rwork | 0.156 |
| R-free | 0.18220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5zjg |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.817 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.560 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.113 | 0.628 |
| Number of reflections | 68628 | 3389 |
| <I/σ(I)> | 16 | |
| Completeness [%] | 97.7 | 100 |
| Redundancy | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 16% PEG 8000, 15% PE G400, 0.1M HEPES pH 7, 25mM L-DON,25mM DON, 80 mM Gly, gamma-butyllactone |
