7Z9B

Sam68

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-06-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.978
Spacegroup name	C 2 2 21
Unit cell lengths	136.726, 237.593, 82.317
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	118.797 - 3.333
Rwork	0.217
R-free	0.25030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5emo
RMSD bond length	0.008
RMSD bond angle	2.025
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	188.800	3.350
High resolution limit [Å]	3.310	3.330
Number of reflections	19923	2867
<I/σ(I)>	7.1
Completeness [%]	99.5
Redundancy	3.7
CC(1/2)	0.996	0.600

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	Ammonium sulfate