6VL3
The crystal structure of the 2009 H1N1 PA endonuclease mutant I38T in complex with SJ000986436
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 | 89.804, 89.804, 132.729 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.180 - 2.680 |
| R-factor | 0.2551 |
| Rwork | 0.253 |
| R-free | 0.29470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5vpt |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.880 | 2.810 |
| High resolution limit [Å] | 2.680 | 2.680 |
| Rmerge | 0.025 | 0.296 |
| Rmeas | 0.030 | 0.350 |
| Rpim | 0.015 | 0.177 |
| Number of reflections | 7558 | 1001 |
| <I/σ(I)> | 16 | 2 |
| Completeness [%] | 95.8 | 97.9 |
| Redundancy | 3.4 | 3.5 |
| CC(1/2) | 1.000 | 0.889 |
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, 10 MM MNCL2, 10 MM MGCL2, 0.5% PVP K15 |
