5U0H

Crystal structure of GH family 9 endoglucanase J30

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-06-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.1271
Spacegroup name	P 65 2 2
Unit cell lengths	91.060, 91.060, 316.660
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	55.870 - 1.700
R-factor	0.1414
Rwork	0.141
R-free	0.16570
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB ID 1CLC
RMSD bond length	0.008
RMSD bond angle	0.981
Data reduction software	xia2
Data scaling software	xia2 (0.3.8.0)
Phasing software	PHENIX
Refinement software	PHENIX (dev_2447)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	76.520	76.520	1.740
High resolution limit [Å]	1.700	7.600	1.700
Rmerge	0.135	0.026	1.313
Rmeas	0.144
Rpim	0.038
Total number of observations	1220921
Number of reflections	86505
<I/σ(I)>	19.3	72.9	2.2
Completeness [%]	100.0	99.9	100
Redundancy	14.1	12.2	12.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	298	trisodium citrate dihydrate, 2-propanol, PEG 10,000