6LMY

Crystal structure of DUSP22 mutant_C88S/S93A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-12-10
Detector	RAYONIX MX300HE
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	89.680, 50.147, 39.699
Unit cell angles	90.00, 94.90, 90.00

Refinement procedure

Resolution	25.610 - 1.500
R-factor	0.1842
Rwork	0.182
R-free	0.21290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wrm
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.16-3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	1.550
High resolution limit [Å]	1.500	3.230	1.500
Rmerge	0.056	0.022	0.625
Rmeas	0.066	0.026	0.741
Rpim	0.034	0.014	0.393
Number of reflections	28189	2817	2802
<I/σ(I)>	14
Completeness [%]	99.5	96.9	99.7
Redundancy	3.6	3.4	3.4
CC(1/2)		0.999	0.742

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	0.2 M imidazole, 0.4 M NaH2PO4, 1.6 M K2HPO4, 0.2 M NaCl