8X1D

Crystal structure of GH11 from Thermoanaerobacterium saccharolyticum (pH8.5)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-04
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9794
Spacegroup name	P 43 21 2
Unit cell lengths	72.798, 72.798, 165.639
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.160 - 1.950
R-factor	0.1728
Rwork	0.171
R-free	0.20890
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8ih0
RMSD bond length	0.007
RMSD bond angle	0.895
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.980
High resolution limit [Å]	1.950	1.950
Number of reflections	33238	1586
<I/σ(I)>	24
Completeness [%]	98.4	97
Redundancy	6.9	4.4
CC(1/2)	1.000	0.480

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		297	Tris, ammonium aceate