8HPZ

Crystal structure of the MlaD domain of the MlaD protein from Escherichia coli (Form I)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU R-AXIS IV
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2020-01-04
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	I 2 2 2
Unit cell lengths	60.280, 107.290, 117.920
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	79.360 - 2.300
R-factor	0.22746
Rwork	0.225
R-free	0.27250
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.867
Data reduction software	MOSFLM (7.4.0)
Data scaling software	Aimless (0.7.9)
Phasing software	PHASER (2.8.3)
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	79.360	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.082	0.595
Rmeas	0.088	0.636
Rpim	0.032	0.223
Total number of observations	137255	13294
Number of reflections	17387	1678
<I/σ(I)>	13.6	3.3
Completeness [%]	99.9
Redundancy	7.9	7.9
CC(1/2)	0.993	0.936

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	5	293	1.8 M sodium phosphate monobasic monohydrate, potassium phosphate dibasic pH 5.0