9H47

EGFR wild type in complex with 26313

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	173
Detector technology	PIXEL
Collection date	2023-12-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.92
Spacegroup name	I 2 3
Unit cell lengths	145.590, 145.590, 145.590
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.040 - 2.991
Rwork	0.200
R-free	0.24380
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.729
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0430 (refmacat 0.4.82))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.040	3.170
High resolution limit [Å]	2.990	2.990
Rmerge	0.451	6.905
Number of reflections	10543	1673
<I/σ(I)>	9.4	0.8
Completeness [%]	100.0	100
Redundancy	40.9	41.2
CC(1/2)	0.998	0.380

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	273	25 mM HEPES pH 8, 150 mM NaCl, 10 % glycerol, 1 mM DTT 85mM Tris pH 7.6, 140 mM acetate, 23.5 % Polyethylene glycol 4,000, 18% glycerol