7XI1

AcrIF 24

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	125
Detector technology	PIXEL
Collection date	2021-06-02
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9794
Spacegroup name	P 65 2 2
Unit cell lengths	62.170, 62.170, 229.100
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.970 - 2.530
R-factor	0.2199
Rwork	0.217
R-free	0.28580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7fa3
RMSD bond length	0.007
RMSD bond angle	0.951
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.970	2.620
High resolution limit [Å]	2.530	2.530
Number of reflections	9494	921
<I/σ(I)>	19.75
Completeness [%]	99.9
Redundancy	37.6
CC(1/2)	0.999	0.754

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	0.4 M Ammonium Chloride 24 % w/v PEG 3350 0.05 M Sodium fluoride