6D7H
CTX-M-14 Apoenzyme
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-08-17 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 41.710, 41.710, 232.524 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 30.681 - 1.801 |
| R-factor | 0.1882 |
| Rwork | 0.183 |
| R-free | 0.23580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ua6 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.105 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| 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 | 1.830 |
| High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
| Rmerge | 0.060 | 0.039 | 0.130 |
| Rmeas | 0.064 | 0.041 | 0.136 |
| Rpim | 0.020 | 0.014 | 0.042 |
| Number of reflections | 41446 | 1247 | 1092 |
| <I/σ(I)> | 11.3 | ||
| Completeness [%] | 98.8 | 92.4 | 100 |
| Redundancy | 10.3 | 8.8 | 10.7 |
| CC(1/2) | 0.997 | 0.993 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 293.15 | 1.0 M potassium phosphate, pH 8.3 |
