7VYZ

Structure of the M. tuberculosis HtrA S367A mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2020-10-20
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	H 3
Unit cell lengths	107.049, 107.049, 61.211
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.540 - 2.401
R-factor	0.2214
Rwork	0.219
R-free	0.26470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ieo
RMSD bond length	0.004
RMSD bond angle	0.851
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.540	2.486
High resolution limit [Å]	2.401	2.401
Number of reflections	10224	1022
<I/σ(I)>	7.9
Completeness [%]	99.9
Redundancy	3.3
CC(1/2)	0.990	0.670

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	7.4	298	0.1M HEPES, 1.4M Sodium Citrate tribasic dihydrate pH 7.5