1JXY

CRAMBIN MIXED SEQUENCE FORM AT 220 K. PROTEIN/WATER SUBSTATES

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	220
Detector technology	DIFFRACTOMETER
Collection date	1990-12-21
Detector	RIGAKU AFC-5R
Spacegroup name	P 1 21 1
Unit cell lengths	40.880, 18.560, 22.410
Unit cell angles	90.00, 90.67, 90.00

Refinement procedure

Resolution	17.670 - 0.890
R-factor	0.145
Rwork	0.145
Starting model (for MR)	1jxx CRAMBIN MIXED FORM AT 200 K.
RMSD bond length	0.011
RMSD bond angle	0.032
Data reduction software	TEXSAN
Data scaling software	TEXSAN
Refinement software	PROLSQ

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	17.670	0.910
High resolution limit [Å]	0.890	0.890
Rmerge	0.079
Number of reflections	27080
<I/σ(I)>	7.7	1.8
Completeness [%]	74.7	45
Redundancy	1	1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	7	293	ethanol, pH 7.00, VAPOR DIFFUSION, SITTING DROP, temperature 293K