9R6H

Crystal Structure of the M18BP1 SANTA domain as a EGFP-SANTA-nanobody fusion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-08
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.0332
Spacegroup name	C 1 2 1
Unit cell lengths	143.200, 120.280, 77.360
Unit cell angles	90.00, 121.28, 90.00

Refinement procedure

Resolution	45.040 - 2.420
R-factor	0.2307
Rwork	0.229
R-free	0.26180
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19_4092)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.040	45.040	2.480
High resolution limit [Å]	2.420	10.820	2.420
Rmerge	0.185	0.076	2.161
Rmeas	0.192	0.079	2.275
Total number of observations	574162
Number of reflections	42294	500	2715
<I/σ(I)>	10.37	32.33	0.97
Completeness [%]	98.5	96.7	86.3
Redundancy	13.575	12.568	10.139
CC(1/2)	0.997	0.995	0.391

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	0.1M MES pH 6.0, 50% PEG400, 5% w/v PEG3000