7MY7

Se-CrtE N-term His-tag structure

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9537
Spacegroup name	C 1 2 1
Unit cell lengths	155.512, 56.443, 144.812
Unit cell angles	90.00, 100.38, 90.00

Refinement procedure

Resolution	48.650 - 2.360
Rwork	0.218
R-free	0.24690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7my6
RMSD bond length	0.007
RMSD bond angle	1.371
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.650	2.430
High resolution limit [Å]	2.360	2.360
Rmerge	0.144	1.578
Rpim	0.083	0.659
Number of reflections	51379	4201
<I/σ(I)>	8.6	1.2
Completeness [%]	99.5	95.1
Redundancy	6.8
CC(1/2)	0.997	0.553

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	200 nL of protein at 10 mg/mL was added to 200 nL of reservoir containing 22.6% (w/v) polyacrylic acid 2100, 1.0% ethylammonium nitrate and 10% (v/v) DL-malate-MES-tris buffer at pH 7.0