7RWV

Crystal structure of a metal-free RIDC1 variant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	80
Detector technology	PIXEL
Collection date	2018-05-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	I 4
Unit cell lengths	92.580, 92.580, 91.260
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.290 - 2.200
R-factor	0.1946
Rwork	0.192
R-free	0.25200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bc5
RMSD bond length	0.016
RMSD bond angle	1.871
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.290	2.280
High resolution limit [Å]	2.200	2.200
Rmerge	0.150	0.544
Rmeas	0.209	0.756
Rpim	0.145	0.523
Number of reflections	19413	1932
<I/σ(I)>	3.7	1.9
Completeness [%]	99.1	99.18
Redundancy	2.5
CC(1/2)	0.984	0.363

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	295	30% PEG400, 0.1 M HEPES, 0.2 M MgCl2