7BLU

Notum_Maybridge_56

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-29
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97627
Spacegroup name	P 21 21 21
Unit cell lengths	59.900, 72.330, 78.280
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.160 - 1.210
R-factor	0.1928
Rwork	0.193
R-free	0.18880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4uz1
Data reduction software	xia2
Data scaling software	xia2
Phasing software	MOLREP
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.570	1.230
High resolution limit [Å]	1.210	1.210
Number of reflections	99435	3282
<I/σ(I)>	16.3
Completeness [%]	95.5
Redundancy	11.6
CC(1/2)	0.999	0.471

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		296	1.5 M Ammonium Sulphate 0.1 M Sodium Citrate, pH4.2