9GL9

Wild-type EGFR bound with STX-721

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-04-21
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000011
Spacegroup name	I 2 3
Unit cell lengths	145.765, 145.765, 145.765
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.360 - 2.147
R-factor	0.1975
Rwork	0.197
R-free	0.21280
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.040
Data reduction software	XDS (Jan 10, 2022)
Data scaling software	Aimless (0.7.9)
Phasing software	PHASER
Refinement software	BUSTER (2.11.8)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	34.357	34.357	2.224
High resolution limit [Å]	2.147	4.622	2.147
Rmerge	0.072	0.035	1.037
Rmeas	0.076	0.036	1.088
Rpim	0.023	0.011	0.330
Total number of observations	288086	29526	30136
Number of reflections	27574	2938	2791
<I/σ(I)>	18.25	49.23	2.49
Completeness [%]	97.8	100	100
Redundancy	10.45	10.05	10.8
CC(1/2)	0.999	0.999	0.818
Anomalous redundancy	5.4	5.3	5.5
CC(ano)	0.006	-0.005	-0.014
|DANO|/σ(DANO)	0.8	0.8	0.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		285	0.1 M HEPES-NaOH pH 6.9, 0.98 M Sodium Succinate pH 7.0, 5 mM TCEP