9WKV

[M322I] Menin complexed with JNJ-75276617

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-08-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.95373
Spacegroup name	P 21 21 21
Unit cell lengths	58.869, 86.732, 202.742
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.760 - 1.800
R-factor	0.16922
Rwork	0.168
R-free	0.19829
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8e90
RMSD bond length	0.011
RMSD bond angle	1.673
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.760	1.820
High resolution limit [Å]	1.790	1.790
Number of reflections	98602	447
<I/σ(I)>	13.8
Completeness [%]	99.6
Redundancy	13.5
CC(1/2)	0.998	0.658

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	18%(w/v) PEG3350, 0.2 M POTASIUM THIOCYANATE, 0.1M MES PH=6.2, 20%(v/v) ETHYLENE GLYCOL, PH 6.2