7M4T

Menin bound to M-1121

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-17
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.12714
Spacegroup name	I 41
Unit cell lengths	153.520, 153.520, 81.930
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.550 - 2.740
R-factor	0.203
Rwork	0.202
R-free	0.21500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6wnh
RMSD bond length	0.008
RMSD bond angle	0.960
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.790
High resolution limit [Å]	2.740	7.430	2.740
Rmerge	0.081	0.034	0.704
Rmeas	0.090	0.037	0.784
Rpim	0.039	0.016	0.341
Total number of observations	134851
Number of reflections	24922	1308	1105
<I/σ(I)>	10.4
Completeness [%]	98.8	99.4	89.8
Redundancy	5.4	5.5	4.7
CC(1/2)		0.995	0.806

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	2.0 M NaCl, 90.9 M Bis-Tris pH 6.5, 0.182 M MgCl2, 10 mM Pr Acetate