2BRY
Crystal structure of the native monooxygenase domain of MICAL at 1.45 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 76.588, 89.548, 83.458 |
| Unit cell angles | 90.00, 114.35, 90.00 |
Refinement procedure
| Resolution | 76.030 - 1.450 |
| R-factor | 0.181 |
| Rwork | 0.180 |
| R-free | 0.22200 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.333 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.550 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.060 | 0.680 |
| Number of reflections | 160458 | |
| <I/σ(I)> | 11.3 | 1.4 |
| Completeness [%] | 88.3 | 54.4 |
| Redundancy | 3.1 | 1.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1 M NA ACETATE, PH 4.6 0.2 AMMONIUM SULFATE 30% PEG 2000 MONOMETHYL ETHER |
