9KFL

KRAS G12V and peptide complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2024-06-12
Detector	ADSC QUANTUM 270
Wavelength(s)	0.979
Spacegroup name	P 1
Unit cell lengths	41.840, 83.416, 83.492
Unit cell angles	120.06, 90.07, 89.96

Refinement procedure

Resolution	29.570 - 3.450
R-factor	0.19111
Rwork	0.189
R-free	0.23342
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.664
Data reduction software	XDS
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.570	3.539
High resolution limit [Å]	3.450	3.450
Rmerge	0.105	0.105
Number of reflections	12300	12300
<I/σ(I)>	97.5
Completeness [%]	95.5	70.63
Redundancy	3.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	Polyethylene glycol 3350, 0.2M potassium nitrate (pH 6.8)