9NSA

Crystal Structure of Side-VII IG1 Domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	120
Detector technology	CCD
Collection date	2015-04-16
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.03318
Spacegroup name	P 43 21 2
Unit cell lengths	37.380, 37.380, 189.663
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.420 - 2.510
R-factor	0.2429
Rwork	0.241
R-free	0.27030
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.781
Data reduction software	XDS (20230630)
Data scaling software	STARANISO (3.351)
Phasing software	PHASER (2.7.16)
Refinement software	PHENIX (2.0_5761)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.710
High resolution limit [Å]	2.510	2.510
Rmerge	0.099	0.680
Rmeas	0.108	0.779
Number of reflections	3699	371
<I/σ(I)>	12.16	2.3
Completeness [%]	70.6	36.3
Redundancy	6.3	4
CC(1/2)	0.998	0.711

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.1 M MES pH 6.1, 25% (w/v) PEG 4000, 1% 1,2-Butanediol