5ZUL

Small heat shock protein from Mycobacterium marinum M : Form-3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9792
Spacegroup name	C 2 2 21
Unit cell lengths	92.209, 128.420, 135.379
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	74.900 - 3.750
R-factor	0.36842
Rwork	0.366
R-free	0.40672
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5zs3
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	74.901	4.190
High resolution limit [Å]	3.750	3.750
Rmerge	0.115	0.724
Rpim	0.039	0.254
Number of reflections	8296	2137
<I/σ(I)>	8.9
Completeness [%]	97.1	90.1
Redundancy	9.3	8.7
CC(1/2)		0.880

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		293	0.05M MgCl2.6H2O, 0.1M HEPES pH 7.5 and 30% PEG MME 550