4NXB

Crystal structure of iLOV-I486(2LT) at pH 7.0

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	200
Detector technology	CCD
Collection date	2013-01-03
Detector	RIGAKU Saturn 944HG
Wavelength(s)	1.5418
Spacegroup name	P 1
Unit cell lengths	33.978, 37.696, 53.968
Unit cell angles	83.88, 78.35, 80.40

Refinement procedure

Resolution	31.455 - 2.561
R-factor	0.2223
Rwork	0.222
R-free	0.23540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ees
RMSD bond length	0.004
RMSD bond angle	0.933
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MLPHARE
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.550	2.550
Number of reflections	7658
Completeness [%]	96.4	94.6
Redundancy		1.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP			VAPOR DIFFUSION, SITTING DROP