5M5Z

Chaetomium thermophilum beta-1-3-glucanase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	P 1 21 1
Unit cell lengths	63.774, 85.277, 66.765
Unit cell angles	90.00, 92.83, 90.00

Refinement procedure

Resolution	35.923 - 1.250
R-factor	0.1235
Rwork	0.123
R-free	0.14050
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3eqn
RMSD bond length	0.005
RMSD bond angle	0.883
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.000	1.270
High resolution limit [Å]	1.250	1.250
Rmerge	0.031	0.149
Number of reflections	424202
<I/σ(I)>	16.4	4.6
Completeness [%]	92.8	65.8
Redundancy	2.3	1.9
CC(1/2)	0.990	0.940

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.8	289	1.8 M Na/K phosphate