6A15
Structure of CYP90B1 in complex with cholesterol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL32XU |
Synchrotron site | SPring-8 |
Beamline | BL32XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-07-20 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.818, 80.574, 83.031 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.516 - 1.790 |
R-factor | 0.1594 |
Rwork | 0.158 |
R-free | 0.18700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6a18 |
RMSD bond length | 0.017 |
RMSD bond angle | 1.389 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: 000)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.520 | 1.854 |
High resolution limit [Å] | 1.790 | 1.790 |
Rmerge | 0.118 | 0.487 |
Rmeas | 0.134 | 0.567 |
Number of reflections | 49003 | 48938 |
<I/σ(I)> | 9.61 | 2.37 |
Completeness [%] | 99.4 | 96.52 |
Redundancy | 4.5 | 3.7 |
CC(1/2) | 0.990 | 0.796 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.8 | 293 | 0.1 M trisodium citrate (pH4.8) |