6J19
ATPase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-01-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97776 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 81.580, 129.647, 64.195 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.613 - 1.978 |
| R-factor | 0.1716 |
| Rwork | 0.170 |
| R-free | 0.20820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6jd4 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.857 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.010 |
| High resolution limit [Å] | 1.980 | 5.370 | 1.980 |
| Rmerge | 0.189 | 0.086 | 0.674 |
| Rmeas | 0.197 | 0.090 | 0.735 |
| Rpim | 0.057 | 0.025 | 0.279 |
| Total number of observations | 249653 | ||
| Number of reflections | 23760 | 1318 | 933 |
| <I/σ(I)> | 2.9 | ||
| Completeness [%] | 98.0 | 100 | 77.5 |
| Redundancy | 10.5 | 12.3 | 5.5 |
| CC(1/2) | 0.998 | 0.728 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.1 M MES pH 6.5, 0.2 M sodium chloride, 25% (w/v) PEG3350 |
