5O87
Crystal structure of wild type Aplysia californica AChBP in complex with nicotine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 150 |
Detector technology | CCD |
Collection date | 2016-08-08 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54157 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 210.781, 131.999, 130.655 |
Unit cell angles | 90.00, 103.15, 90.00 |
Refinement procedure
Resolution | 25.200 - 2.200 |
R-factor | 0.20444 |
Rwork | 0.203 |
R-free | 0.23515 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xys |
RMSD bond length | 0.009 |
RMSD bond angle | 1.451 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.200 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.115 | 0.639 |
Number of reflections | 176070 | 8731 |
<I/σ(I)> | 8.8 | 3.3 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 6.8 | 6.7 |
CC(1/2) | 0.993 | 0.675 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.45 M ammonium phosphate monobasic 2 % glycerol 2 % IPA |