8DJ6

Sliding-clamp-ImuB peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-22
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.000
Spacegroup name	C 1 2 1
Unit cell lengths	214.110, 124.832, 117.262
Unit cell angles	90.00, 113.75, 90.00

Refinement procedure

Resolution	46.750 - 2.500
R-factor	0.2002
Rwork	0.200
R-free	0.22610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4tr7
RMSD bond length	0.002
RMSD bond angle	0.502
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.750	2.540
High resolution limit [Å]	2.500	2.500
Rmerge	0.123	0.988
Rpim	0.082	0.671
Number of reflections	94524	4590
<I/σ(I)>	10.3	0.88
Completeness [%]	96.4
Redundancy	3
CC(1/2)	0.963	0.400

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.5	0.1M Bis -Tris pH6.3, 60% Tascimate pH7