5BV5
Structure of CYP119 with T213A and C317H mutations
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-07-25 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.486, 137.871, 91.779 |
Unit cell angles | 90.00, 101.18, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.700 |
R-factor | 0.24038 |
Rwork | 0.238 |
R-free | 0.27673 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.852 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | |
High resolution limit [Å] | 2.700 | 2.700 |
Number of reflections | 40139 | |
<I/σ(I)> | 10.7 | 1.6 |
Completeness [%] | 98.5 | 97.6 |
Redundancy | 3.3 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.25 | 298 | 0.1 M Tris-HCl, 5 % PEG 4000 |