8RTL

Af Aio C65F-C80G

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-01-10
Detector	DECTRIS EIGER2 R 1M
Wavelength(s)	0.97372
Spacegroup name	P 1
Unit cell lengths	90.164, 108.797, 117.109
Unit cell angles	97.58, 90.04, 96.18

Refinement procedure

Resolution	116.070 - 1.890
R-factor	0.20172
Rwork	0.200
R-free	0.23514
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	2.120
Data reduction software	XDS
Data scaling software	XDS
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	116.070	1.920
High resolution limit [Å]	1.890	1.890
Number of reflections	326409	8617
<I/σ(I)>	6.1
Completeness [%]	92.9
Redundancy	3.2
CC(1/2)	0.989	0.390

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277.15	PEG 4000