6CIM

Pre-Reaction Complex, RAG1(E962Q)/2-nicked/intact 12/23RSS complex in Mn2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2017-02-16
Detector	RAYONIX MX300-HS
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	156.678, 123.562, 186.286
Unit cell angles	90.00, 105.60, 90.00

Refinement procedure

Resolution	38.693 - 3.600
R-factor	0.216
Rwork	0.214
R-free	0.25370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6cik
Data reduction software	HKL-2000
Data scaling software	SCALA
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.660
High resolution limit [Å]	3.600	3.600
Rmerge	0.119	0.999
Rmeas	0.139	1.164
Rpim	0.072	0.593
Number of reflections	39753	1956
<I/σ(I)>	14.6	1.5
Completeness [%]	100.0	100
Redundancy	3.8	3.8
CC(1/2)		0.574

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.9	277	18% PEG3350, 200 mM KNO3, 50 mM HEPES pH 6.9