4JJO

crystal structure of apo-clavibacter Michiganensis expansin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	93
Detector technology	CCD
Collection date	2012-03-27
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	36.182, 76.528, 36.048
Unit cell angles	90.00, 99.88, 90.00

Refinement procedure

Resolution	26.030 - 1.750
R-factor	0.1684
Rwork	0.166
R-free	0.19510
Starting model (for MR)	3d30
RMSD bond length	0.003
RMSD bond angle	0.828
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	75.000	50.000	1.780
High resolution limit [Å]	1.750	4.750	1.750
Rmerge	0.103		0.319
Number of reflections	17595
Completeness [%]	90.4	98.1	76.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.3	294	0.2M Ammonium Nitrate, 20% PEG3350 , pH 7.3, VAPOR DIFFUSION, SITTING DROP, temperature 294K