8IIH

H109C mutant of uracil DNA glycosylase X

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2021-02-28
Detector	RIGAKU RAXIS
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	36.380, 51.510, 54.900
Unit cell angles	90.00, 104.67, 90.00

Refinement procedure

Resolution	26.560 - 2.130
R-factor	0.1745
Rwork	0.172
R-free	0.22170
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.973
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.060	2.190
High resolution limit [Å]	2.130	2.130
Rmerge	0.099	0.345
Rmeas	0.137	0.470
Rpim	0.095	0.317
Number of reflections	10487	899
<I/σ(I)>	6.8	2.3
Completeness [%]	94.2
Redundancy	3.1
CC(1/2)	0.989	0.824

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	7	295	2.0M Ammonium citrate tribasic pH7.0, 0.1M BIS-TRIS propane pH7.0