7TLI

THERMOLYSIN (90% ISOPROPANOL SOAKED CRYSTALS)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1997-06-01
Detector	MAR scanner 300 mm plate
Spacegroup name	P 61 2 2
Unit cell lengths	93.270, 93.270, 130.360
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.950
Rwork	0.171
R-free	0.21300
Structure solution method	ISOMORPHOUS REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	0.034
Data reduction software	DENZO
Data scaling software	CCP4
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.060
High resolution limit [Å]	1.950	1.950
Rmerge	0.073	0.260
Number of reflections	23150
<I/σ(I)>	6.2	2.9
Completeness [%]	93.0	91
Redundancy	5.8	4.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		4.6MM THERMOLYSIN, 45% DMSO, 50MM TRIS-HCL, 2.5M CSCL, PH 7.5, pH 7.50