9DQL
human ClpP - Bortezomib - A192E / E196R
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-11-23 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.95358 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 122.190, 93.880, 133.720 |
| Unit cell angles | 90.00, 97.87, 90.00 |
Refinement procedure
| Resolution | 44.240 - 3.200 |
| R-factor | 0.1877 |
| Rwork | 0.186 |
| R-free | 0.23680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.521 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.080 | 3.090 |
| High resolution limit [Å] | 3.030 | 3.030 |
| Number of reflections | 114141 | 3791 |
| <I/σ(I)> | 8.9 | 0.67 |
| Completeness [%] | 99.8 | |
| Redundancy | 6.8 | |
| CC(1/2) | 0.998 | 0.246 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 200 mM potassium acetate, 35% (v/v) pentaerythritol propoxylate (5/4 PO/OH) |
