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