7VNH
drosophlia AHR PAS-B domain bound by the antagonist alpha-naphthoflavone
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2020-01-06 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.58 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 60.235, 60.235, 121.046 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.262 - 2.402 |
R-factor | 0.2347 |
Rwork | 0.231 |
R-free | 0.26770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3f1o |
RMSD bond length | 0.004 |
RMSD bond angle | 0.700 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.300 | 2.450 |
High resolution limit [Å] | 2.400 | 2.400 |
Number of reflections | 9195 | 526 |
<I/σ(I)> | 16.3 | |
Completeness [%] | 99.9 | |
Redundancy | 20 | |
CC(1/2) | 0.992 | 0.770 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Tris-HCl pH 7.0, 0.2 M NaCl, 0.8 M sodium citrate |