5N0W
Crystal structure of OphA-DeltaC6 mutant R72A in complex with SAM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-10-15 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 163.098, 92.276, 85.684 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.800 - 1.930 |
R-factor | 0.19476 |
Rwork | 0.194 |
R-free | 0.21609 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5n0o |
RMSD bond length | 0.008 |
RMSD bond angle | 1.380 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.800 | 2.020 |
High resolution limit [Å] | 1.930 | 1.930 |
Rmerge | 0.071 | 0.568 |
Number of reflections | 96972 | |
<I/σ(I)> | 17.4 | 1.3 |
Completeness [%] | 98.7 | 97.5 |
Redundancy | 4.4 | 3.8 |
CC(1/2) | 0.996 | 0.768 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.3-0.4 M KSCN, 1.5-1.9 M sodium malonate and 0.1 M bicine pH 9.0 |