2WNO

X-ray Structure of CUB_C domain from TSG-6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	2005-05-01
Detector	RIGAKU R-AXIS IV
Spacegroup name	P 43 21 2
Unit cell lengths	56.929, 56.929, 112.572
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.260 - 2.300
R-factor	0.193
Rwork	0.191
R-free	0.22800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	HOMOLOGY MODEL OF TARGETS BASED UPON 1SZB
RMSD bond length	0.007
RMSD bond angle	1.113
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.300	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.080	0.570
Number of reflections	8616
<I/σ(I)>	8.5	1.3
Completeness [%]	98.7	92.1
Redundancy	5.4	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		100MM HEPES PH 7.5 200MM MGSO4 22% (W/V) PEG 1000