4CRZ

Direct visualisation of strain-induced protein prost-translational modification

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	298
Detector technology	IMAGE PLATE
Collection date	2013-12-03
Detector	RIGAKU R-AXIS IV
Spacegroup name	I 4
Unit cell lengths	86.280, 86.280, 80.880
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.520 - 1.700
R-factor	0.14611
Rwork	0.145
R-free	0.17519
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4azd
RMSD bond length	0.023
RMSD bond angle	2.333
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.700	1.740
High resolution limit [Å]	1.700	1.700
Rmerge	0.040	0.400
Number of reflections	32244
<I/σ(I)>	13.3	2.2
Completeness [%]	99.7	99.7
Redundancy	2.4	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.4		20% (W/V) POLYETHYLENE GLYCOL (PEG) 3350, 0.1 M BIS-TRIS PROPANE PH 7.4, 0.2 M POTASSIUM THIOCYANATE