5E5U

Crystal structure of the complex between Carbonic anhydrase-like domain of PTPRG and Immunoglobulin domains 2-3 of CNTN6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-BM
Synchrotron site	APS
Beamline	22-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2013-03-13
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	78.641, 113.530, 117.046
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.891 - 2.000
R-factor	0.17
Rwork	0.168
R-free	0.21660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kld
RMSD bond length	0.007
RMSD bond angle	1.049
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.070
High resolution limit [Å]	2.000	4.310	2.000
Rmerge	0.096	0.044	0.593
Total number of observations	500144
Number of reflections	70482
<I/σ(I)>	6.4
Completeness [%]	98.7	99.7	89.2
Redundancy	7.1	7.2	5.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	55% (v/v) Tacsimate pH 7.0, 150 mM NDSB 201