7B2Z

Notum complex with ARUK3003907

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	2020-11-24
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9763
Spacegroup name	P 21 21 21
Unit cell lengths	59.661, 72.165, 77.930
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.980 - 1.240
R-factor	0.1965
Rwork	0.196
R-free	0.20870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7arg
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.950	1.260
High resolution limit [Å]	1.240	1.240
Number of reflections	95918	4739
<I/σ(I)>	19.6
Completeness [%]	100.0
Redundancy	25.9
CC(1/2)	1.000	0.810

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	4.2	296	1.5 M Ammonium Sulphate 0.1 M Sodium Citrate