7WVR

Crystal structure of Talaromyces leycettanus JCM12802 expansin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	C 2 2 21
Unit cell lengths	47.862, 117.627, 99.203
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.300 - 1.410
R-factor	0.1622
Rwork	0.161
R-free	0.17560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4jcw
RMSD bond length	0.005
RMSD bond angle	0.792
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.300	1.457
High resolution limit [Å]	1.407	1.407
Rmerge		0.329
Rmeas		0.466
Number of reflections	50454	3433
<I/σ(I)>	16.48	2.34
Completeness [%]	92.3
Redundancy	2
CC(1/2)	0.999	0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	1.8 M ammonium sulfate, 0.1 M Bis-Tris (pH 6.5), and 2% PEG monomethyl ether 550