7KOP
The crystal structure of the 2009/H1N1/California PA endonuclease I38T mutant in complex with SJ000988539
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2019-09-13 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.000 |
| Spacegroup name | I 4 2 2 |
| Unit cell lengths | 89.594, 89.594, 131.826 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.680 - 2.330 |
| R-factor | 0.2076 |
| Rwork | 0.207 |
| R-free | 0.22830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5vpt |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.567 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (dev_3965) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.680 | 2.410 |
| High resolution limit [Å] | 2.330 | 2.330 |
| Rmerge | 0.061 | |
| Rmeas | 0.067 | |
| Rpim | 0.027 | 0.468 |
| Number of reflections | 11600 | 1135 |
| <I/σ(I)> | 19.8 | 2 |
| Completeness [%] | 98.6 | 99.5 |
| Redundancy | 5.9 | 6 |
| CC(1/2) | 0.999 | 0.765 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M HEPES PH 7.8, 1 M AMMONIUM SULFATE, 0.1M MGCL2, 0.5% PVP K15 |
