8EZG

Monobody 12D1 bound to KRAS(G12D)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-24
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97918
Spacegroup name	P 64 2 2
Unit cell lengths	156.477, 156.477, 64.624
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.170 - 2.520
R-factor	0.173
Rwork	0.171
R-free	0.21310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 7L0G & 5VPZ
RMSD bond length	0.008
RMSD bond angle	0.936
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: 000))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.560
High resolution limit [Å]	2.520	2.520
Rmerge	0.092	0.324
Rmeas	0.098	0.344
Rpim	0.033	0.113
Number of reflections	16221	798
<I/σ(I)>	20.3	7.4
Completeness [%]	99.9	99.9
Redundancy	8.7	9
CC(1/2)	0.986	0.973

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	2.8 M sodium acetate trihydrate