7B2D
Complement inhibitor CirpA1 from Rhipicephalus pulchellus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-31 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 2 2 21 |
| Unit cell lengths | 72.676, 45.806, 57.453 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.070 - 1.960 |
| R-factor | 0.1941 |
| Rwork | 0.193 |
| R-free | 0.21920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zui |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.887 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.070 | 2.110 |
| High resolution limit [Å] | 1.960 | 1.960 |
| Rmerge | 0.122 | 1.317 |
| Number of reflections | 14374 | 1047 |
| <I/σ(I)> | 11.5 | |
| Completeness [%] | 100.0 | |
| Redundancy | 11.4 | |
| CC(1/2) | 0.998 | 0.571 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M imidazole malate, pH 6, 30% (w/v) PEG4000 |
