7C8S

Crystal structure of DUSP22 mutant_N128A

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	2018-12-23
Detector	RAYONIX MX300HE
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	89.842, 50.432, 40.212
Unit cell angles	90.00, 95.96, 90.00

Refinement procedure

Resolution	22.530 - 1.310
R-factor	0.1879
Rwork	0.187
R-free	0.19650
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wrm
RMSD bond length	0.005
RMSD bond angle	0.792
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.16-3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	1.360
High resolution limit [Å]	1.310	2.820	1.310
Rmerge	0.053	0.033	0.645
Rmeas		0.039	0.755
Rpim		0.021	0.388
Number of reflections	42476	4302	4184
<I/σ(I)>	22.03
Completeness [%]	98.6	97.8	97.4
Redundancy	3.7	3.5	3.7
CC(1/2)		0.998	0.719

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	0.1 M HEPES, 30% PEG 3,350, 0.2 M Li2SO4