6WAU
Complex structure of PHF19
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-05-12 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.97951 |
| Spacegroup name | P 32 |
| Unit cell lengths | 111.477, 111.477, 34.409 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.271 - 1.750 |
| Rwork | 0.213 |
| R-free | 0.24970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4hcz |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.994 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 55.740 | 55.740 | 1.740 |
| High resolution limit [Å] | 1.710 | 9.020 | 1.710 |
| Rmerge | 0.048 | 0.015 | 1.314 |
| Rmeas | 0.054 | 0.017 | 1.608 |
| Rpim | 0.023 | 0.007 | 0.906 |
| Total number of observations | 279619 | 1994 | 7418 |
| Number of reflections | 51838 | 352 | 2547 |
| <I/σ(I)> | 21.6 | 95.8 | 0.7 |
| Completeness [%] | 99.4 | 99.6 | 92.1 |
| Redundancy | 5.4 | 5.7 | 2.9 |
| CC(1/2) | 1.000 | 1.000 | 0.190 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 2.3M ammonium phosphate dibasic and 0.1M Tris pH 8.5 |
