8V5X

UIC-1 mutant - UIC-1-L6A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-04-27
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.619920
Spacegroup name	C 1 2 1
Unit cell lengths	50.801, 16.792, 20.200
Unit cell angles	90.00, 103.99, 90.00

Refinement procedure

Resolution	17.550 - 1.120
R-factor	0.1718
Rwork	0.167
R-free	0.21700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.814
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	17.550	1.160
High resolution limit [Å]	1.120	1.120
Rmerge	0.119	0.752
Rmeas	0.130	0.830
Number of reflections	6420	593
<I/σ(I)>	8.69	2.55
Completeness [%]	98.1	94.59
Redundancy	6.3	5.7
CC(1/2)	0.996	0.734

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	SLOW COOLING		298	water, acetonitrile