5KAU
The structure of SAV2435 bound to RHODAMINE 6G
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-02-04 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 73.347, 73.347, 65.342 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.670 - 1.950 |
R-factor | 0.1631 |
Rwork | 0.162 |
R-free | 0.18710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lur |
RMSD bond length | 0.019 |
RMSD bond angle | 1.635 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.670 |
High resolution limit [Å] | 1.950 |
<I/σ(I)> | 23.8 |
Completeness [%] | 99.9 |
Redundancy | 7.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 2.4 M ammonium sulfate, 0.1 M Tris pH 8.5 |