2WPH

factor IXa superactive triple mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2007-07-13
Detector	MARRESEARCH
Spacegroup name	P 21 21 21
Unit cell lengths	44.290, 66.490, 97.620
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	7.000 - 1.500
R-factor	0.24
Rwork	0.240
R-free	0.26700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1rfn
RMSD bond length	0.013
RMSD bond angle	1.840
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	CNS (1.21)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	7.000	1.530
High resolution limit [Å]	1.480	1.480
Rmerge	0.080	0.620
Number of reflections	44244
<I/σ(I)>	19.1	2
Completeness [%]	95.0	81
Redundancy	7.8	6.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		22 % PEG 3000, 100 MM BIS/TRIS, PH 6.85