9R56

Wee1-like kinase in complex wirh MIPS-54861

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-03-30
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.953738
Spacegroup name	P 1 21 1
Unit cell lengths	50.224, 69.029, 88.957
Unit cell angles	90.00, 91.40, 90.00

Refinement procedure

Resolution	54.530 - 3.010
R-factor	0.2413
Rwork	0.236
R-free	0.29180
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.553
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	54.530	3.060
High resolution limit [Å]	3.010	3.010
Rmerge	0.244	3.911
Rmeas	0.264	4.209
Rpim	0.100	1.547
Number of reflections	12207	613
<I/σ(I)>	6.3	0.3
Completeness [%]	100.0	100
Redundancy	7	7.3
CC(1/2)	0.986	0.237

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20% PEG6000, 10% ethylene glycol, 0.1M MES pH 6.0, 0.2M ammonium chloride