5HCW
Crystal structure of C-As lyase with mutations Y100H and V102F (monoclinic form)
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 | 2015-11-11 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.925, 79.683, 70.862 |
| Unit cell angles | 90.00, 101.07, 90.00 |
Refinement procedure
| Resolution | 35.429 - 2.785 |
| R-factor | 0.1985 |
| Rwork | 0.194 |
| R-free | 0.28250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.417 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.880 |
| High resolution limit [Å] | 2.780 | 2.780 |
| Rmerge | 0.098 | 0.412 |
| Number of reflections | 11380 | |
| <I/σ(I)> | 10.9 | 2 |
| Completeness [%] | 96.0 | 77.7 |
| Redundancy | 3.3 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 30% Peg 4000, 0.1 M Na acetate, 0.2 M NH4 sulfate |
