4XI7

Crystal structure of the MZM-REP domains of Mind bomb 1 in complex with Jagged1 N-box peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2013-08-08
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97918
Spacegroup name	P 41 2 2
Unit cell lengths	73.728, 73.728, 170.276
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.849 - 2.051
R-factor	0.198
Rwork	0.197
R-free	0.22360
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.794
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.090
High resolution limit [Å]	2.050	5.560	2.050
Rmerge	0.092	0.039	0.627
Total number of observations	293868
Number of reflections	29272
<I/σ(I)>	6.2
Completeness [%]	96.3	94.8	94.5
Redundancy	10	9.2	9.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	Protein at 6 mg/mL in 25 mM HEPES 7.4, 500 mM NaCl, 10% w/v glucose, 100 mM Arg, 2 mM TCEP Precipitant: 1.5 M (NH4)2SO4, 20% v/v glycerol, HEPES pH 7.6 1:1 drop volume