7PRJ

Factor XII Fibronectin type II (FXII FnII) domain

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-01-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.2821
Spacegroup name	P 21 21 21
Unit cell lengths	26.350, 40.880, 45.330
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.781 - 1.200
R-factor	0.1944
Rwork	0.192
R-free	0.23850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1h8p
RMSD bond length	0.007
RMSD bond angle	0.990
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.360	3.790
High resolution limit [Å]	1.200	1.200
Number of reflections	15507	15507
<I/σ(I)>	4.02
Completeness [%]	97.3
Redundancy	4.5
CC(1/2)	0.993	0.993

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		292.15	0.01 M Zinc chloride, 0.1 M Sodium acetate pH 5.0, 20 % (w/v) PEG 6000