5K0H

Human factor Xa in complex with synthetic inhibitor benzylsulfonyl-dSer(Benzyl)-Gly-4-amidinobenzylamide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron site	MPG/DESY, HAMBURG
Beamline	BW6
Temperature [K]	100
Detector technology	CCD
Collection date	2001-10-10
Detector	MARRESEARCH
Wavelength(s)	1.05
Spacegroup name	P 21 21 21
Unit cell lengths	56.280, 72.400, 77.130
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.250 - 2.200
R-factor	0.214
Rwork	0.214
R-free	0.26100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1eqz
RMSD bond length	0.006
RMSD bond angle	1.200
Refinement software	CNX (2000.1)

Data quality characteristics

	Overall
Low resolution limit [Å]	19.250
High resolution limit [Å]	2.200
Number of reflections	16187
<I/σ(I)>	26.2
Completeness [%]	98.0
Redundancy	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM MES, 12-18 % PEG6000, 5 mM CaCl2