6QSC
Crystal Structure of Arg470His mutant of Human Prolidase with Mn ions and GlyPro ligand
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 | 2018-11-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9184 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 103.541, 108.714, 211.548 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.347 - 1.569 |
| R-factor | 0.1471 |
| Rwork | 0.147 |
| R-free | 0.16740 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5m4q |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.350 | 1.660 |
| High resolution limit [Å] | 1.569 | 1.569 |
| Rmerge | 0.071 | 1.212 |
| Rmeas | 0.077 | 1.299 |
| Number of reflections | 165436 | 26391 |
| <I/σ(I)> | 16.61 | 1.47 |
| Completeness [%] | 99.8 | 99.3 |
| Redundancy | 7.49 | 7.66 |
| CC(1/2) | 0.999 | 0.649 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 10mM NaTetraBorate, 690-760mM NaCitrate |
