4H3M
mPlumAYC-E16A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 90 |
| Detector technology | PIXEL |
| Collection date | 2012-03-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.5418, 1.5621, 1.7321 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 61.240, 64.690, 94.770 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.260 - 2.000 |
| R-factor | 0.2178 |
| Rwork | 0.215 |
| R-free | 0.27440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2qlg |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.397 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASES |
| Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 53.429 | 6.320 | 2.110 |
| High resolution limit [Å] | 2.000 | 4.470 | 2.000 |
| Rmerge | 0.103 | 0.150 | |
| Number of reflections | 23844 | ||
| <I/σ(I)> | 6 | 4.4 | |
| Completeness [%] | 92.2 | 85.5 | 95.1 |
| Redundancy | 2.6 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.3 uL + 0.3 uL drops, precipitant: 200 mM magnesium chloride, 100 mM sodium cacodylate, pH 6.5, 50% (v/v) PEG200, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
