6F9M
The LIPY/F-motif in an intracellular subtilisin protease is involved in inhibition
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-09-30 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 70.170, 85.180, 104.580 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.563 - 1.298 |
| R-factor | 0.1304 |
| Rwork | 0.130 |
| R-free | 0.15030 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xrm |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.962 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 66.050 | 1.320 |
| High resolution limit [Å] | 1.298 | 1.298 |
| Rpim | 0.026 | 0.412 |
| Number of reflections | 142753 | 7606 |
| <I/σ(I)> | 16.4 | 2.2 |
| Completeness [%] | 92.2 | 99.1 |
| Redundancy | 4.7 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.25 M NH4Ac, 21.73 % PEG 1500, 0.1 M Na-Citrate pH 4.0 |
