4DJL

Carboxypeptidase T with N-sulfamoyl-L-phenylalanine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	100
Detector technology	CCD
Collection date	2011-10-09
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.8
Spacegroup name	P 63 2 2
Unit cell lengths	157.949, 157.949, 104.197
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	16.000 - 1.550
R-factor	0.157
Rwork	0.156
R-free	0.17405
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.121
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	1.500
Number of reflections	122520
Completeness [%]	99.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	COUNTER-DIFFUSION		273	Counter diffusion, temperature 273K