7SOG

Thermostable actophorin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	53.720, 41.290, 55.500
Unit cell angles	90.00, 95.84, 90.00

Refinement procedure

Resolution	36.580 - 1.740
R-factor	0.1936
Rwork	0.191
R-free	0.22510
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7rtx
RMSD bond length	0.007
RMSD bond angle	0.744
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.580	1.802
High resolution limit [Å]	1.740	1.740
Rmerge	0.055	0.617
Rmeas	0.066	0.727
Number of reflections	24315	2410
<I/σ(I)>	13.1	2.49
Completeness [%]	94.9	89.89
Redundancy	3.4
CC(1/2)	0.999	0.769

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	PEG 8000, NISO4, MES pH6.5