5RG6
Crystal Structure of Kemp Eliminase HG3.7 in unbound state, 277K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 277 |
| Detector technology | PIXEL |
| Collection date | 2018-06-01 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.1158 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 76.200, 79.850, 98.810 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 60.340 - 1.350 |
| Rwork | 0.126 |
| R-free | 0.14090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | XDS |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 60.340 | 60.400 | 1.370 |
| High resolution limit [Å] | 1.350 | 3.660 | 1.350 |
| Rmeas | 0.074 | 0.051 | 0.557 |
| Rpim | 0.029 | 0.020 | 0.246 |
| Total number of observations | 828375 | 42430 | 28520 |
| Number of reflections | 131151 | 6994 | 6009 |
| <I/σ(I)> | 13 | 31.5 | 2.3 |
| Completeness [%] | 99.0 | 99.9 | 91.8 |
| Redundancy | 6.3 | 6.1 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 277 | 1.8-2.4 M Ammonium Sulfate, 4mg/mL Protein Concentration, 100mM Sodium Acetate |
