7RWX

Crystal structure of a Zn-bound RIDC1 variant in the presence of reductant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	H 3 2
Unit cell lengths	111.649, 111.649, 148.326
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.010 - 1.600
R-factor	0.2429
Rwork	0.239
R-free	0.29050
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bc5
RMSD bond length	0.010
RMSD bond angle	1.118
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	80.690	1.640
High resolution limit [Å]	1.600	1.600
Rmerge	0.078	0.312
Rmeas	0.089	0.366
Rpim	0.042	0.185
Number of reflections	27879	7175
<I/σ(I)>	8.5	2.7
Completeness [%]	96.2	91.3
Redundancy	4.1	3.7
CC(1/2)	0.995	0.898

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 CaCl2