9DPW
BMP-9 K357R G389S Dimer With Radiation Damage in Neutral pH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-17 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1 |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 71.100, 71.100, 145.548 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.080 - 2.710 |
| R-factor | 0.227 |
| Rwork | 0.224 |
| R-free | 0.29860 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.357 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.080 | 2.840 |
| High resolution limit [Å] | 2.710 | 2.710 |
| Rmerge | 0.443 | 4.532 |
| Rmeas | 0.511 | 5.208 |
| Rpim | 0.247 | 2.505 |
| Number of reflections | 5360 | 706 |
| <I/σ(I)> | 4.2 | 1.4 |
| Completeness [%] | 99.6 | 99.6 |
| Redundancy | 6.9 | 7.4 |
| CC(1/2) | 0.948 | 0.309 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289.15 | 1M NaCl, 22-26% glycerol, 0.1 M HEPES pH 7.5 |
