2I2C
Crystal structure of LmNADK1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-04-11 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9793 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 63.070, 75.297, 118.650 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 23.290 - 1.850 |
| R-factor | 0.192 |
| Rwork | 0.191 |
| R-free | 0.21000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2i2b |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.451 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.300 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.068 | 0.442 |
| Number of reflections | 22941 | |
| <I/σ(I)> | 17.3 | 1.9 |
| Completeness [%] | 98.9 | 93.5 |
| Redundancy | 5.2 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.4 | 0.3 M POTASSIUM CHLORIDE, 50 MM TRI-SODIUM CITRATE DIHYDRATE, 15-20% W/V POLYETHYLENE GLYCOL 400, pH 5.4, VAPOR DIFFUSION, HANGING DROP |
