6IY8

DmpR-phenol complex of Pseudomonas putida

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]	193
Detector technology	CCD
Collection date	2016-11-12
Detector	ADSC QUANTUM 270
Wavelength(s)	1
Spacegroup name	P 21 21 2
Unit cell lengths	178.636, 129.998, 110.276
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.120 - 3.420
R-factor	0.2382
Rwork	0.233
R-free	0.28560
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.701
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.120	9.150
High resolution limit [Å]	3.420	3.420
Rmerge		0.850
Number of reflections	31309	4372
<I/σ(I)>	8.52
Completeness [%]	90.5
Redundancy	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	340mM Na/K-tartarate, 80mM Glycine, 3mM AMP-PNP, 10mM phenol