5O7E
Crystal structure of the peptidase domain of collagenase H from Clostridium histolyticum in complex with N-aryl mercaptoacetamide-based inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-09-27 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.304, 79.677, 56.959 |
| Unit cell angles | 90.00, 91.23, 90.00 |
Refinement procedure
| Resolution | 46.330 - 1.870 |
| R-factor | 0.1922 |
| Rwork | 0.190 |
| R-free | 0.22640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4arf |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.818 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.3_1479) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 46.330 |
| High resolution limit [Å] | 1.870 |
| Number of reflections | 37834 |
| <I/σ(I)> | 8.8 |
| Completeness [%] | 99.5 |
| Redundancy | 1.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.4 | 293.15 | polyethylene glycol methyl ether 2000, NaCl, MES |
