1QL9

FACTOR XA SPECIFIC INHIBITOR IN COMPLEX WITH RAT TRYPSIN MUTANT X99RT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RUH3R
Temperature [K]	287
Detector technology	IMAGE PLATE
Collection date	1998-08-15
Detector	RIGAKU IMAGE PLATE
Spacegroup name	I 2 3
Unit cell lengths	124.140, 124.140, 124.140
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	10.000 - 2.300
R-factor	0.189
Rwork	0.189
Structure solution method	OTHER
RMSD bond length	0.007
RMSD bond angle	25.700 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR (3.1)
Refinement software	X-PLOR (3.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.000	2.280
High resolution limit [Å]	2.200	2.200
Rmerge	0.100	0.456
Total number of observations	57863 *
Number of reflections	16310
<I/σ(I)>	12.4
Completeness [%]	99.9	99.9
Redundancy	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	7		a single crystal was soaked *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	protein	13.5 (mg/ml)
2	1	1	benzamidine	100 (mM)
3	1	1	Tris-HCl	25 (mM)
4	1	1		10 (mM)
5	1	1		40 (%)