9I7F
Crystal structure of HRP-2 PWWP domain with C64S mutation - Crystal form P21 type 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-12-21 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.98011 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.686, 80.923, 108.723 |
| Unit cell angles | 90.00, 102.34, 90.00 |
Refinement procedure
| Resolution | 53.100 - 2.080 |
| R-factor | 0.2013 |
| Rwork | 0.199 |
| R-free | 0.25431 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.824 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.110 | 2.190 |
| High resolution limit [Å] | 2.080 | 2.080 |
| Rmerge | 0.172 | 1.753 |
| Rmeas | 0.186 | 1.893 |
| Rpim | 0.070 | 0.708 |
| Total number of observations | 43701 | |
| Number of reflections | 42492 | 6197 |
| <I/σ(I)> | 7.4 | 1 |
| Completeness [%] | 100.0 | |
| Redundancy | 7 | 7.1 |
| CC(1/2) | 0.993 | 0.639 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0.2 M Ammonium acetate 27% PEG 4000 0.1 M Sodium citrate pH 5.6 |
