5FRZ

crystal structure of the phenol-responsive sensory domain of the transcription activator PoxR with 3,4-dimethylphenol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	287
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 21 21 21
Unit cell lengths	45.851, 70.583, 104.956
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.926 - 2.100
R-factor	0.2218
Rwork	0.218
R-free	0.29440
Structure solution method	MIR
Starting model (for MR)	NONE
RMSD bond length	0.009
RMSD bond angle	1.169
Refinement software	PHENIX ((PHENIX.REFINE: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.670
High resolution limit [Å]	1.640	1.640
Rmerge	0.060	0.970
Number of reflections	41911
<I/σ(I)>	57.21	2.45
Completeness [%]	98.0	99.5
Redundancy	13.6	11.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1