7UMO

Structure of Unc119-inhibitor complex.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2021-10-28
Detector	RDI CMOS_8M
Wavelength(s)	1.0722
Spacegroup name	P 21 21 21
Unit cell lengths	75.820, 78.130, 187.070
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.160 - 2.300
R-factor	0.1989
Rwork	0.197
R-free	0.24240
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3rbq
RMSD bond length	0.004
RMSD bond angle	0.808
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.160	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.089	0.693
Rmeas	0.093	0.719
Rpim	0.025	0.191
Number of reflections	50240	4543
<I/σ(I)>	20.3	4.5
Completeness [%]	100.0	100
Redundancy	13.8	14
CC(1/2)	0.999	0.947

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	277	Cacodylate, Sodium acetate, PEG4000