3ZDG
Crystal Structure of Ls-AChBP complexed with carbamoylcholine analogue 3-(dimethylamino)butyl dimethylcarbamate (DMABC)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-2 |
| Synchrotron site | MAX II |
| Beamline | I911-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-18 |
| Detector | MARRESEARCH SX-165 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 123.730, 144.880, 139.030 |
| Unit cell angles | 90.00, 107.90, 90.00 |
Refinement procedure
| Resolution | 37.338 - 2.480 |
| R-factor | 0.1753 |
| Rwork | 0.173 |
| R-free | 0.22090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1uv6 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.289 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE: 1.8.1_1168)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.340 | 2.610 |
| High resolution limit [Å] | 2.480 | 2.480 |
| Rmerge | 0.060 | 0.200 |
| Number of reflections | 164848 | |
| <I/σ(I)> | 13.8 | 4.8 |
| Completeness [%] | 99.6 | 97.8 |
| Redundancy | 3.4 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 0.1 M TRIS (AT PH 8.5 ), 2.0 M AMMONIUM SULPHATE |
