5SX4

Crystal Structure of panitumumab in complex with epidermal growth factor receptor domain 3.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	80
Detector technology	CCD
Collection date	2013-05-17
Detector	ADSC QUANTUM 315
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	65.273, 113.184, 232.443
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.596 - 2.800
R-factor	0.2255
Rwork	0.223
R-free	0.26610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yy9
RMSD bond length	0.002
RMSD bond angle	0.485
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (dev_2356)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	2.900
High resolution limit [Å]	2.800	6.020	2.800
Rmerge	0.098	0.057	0.502
Total number of observations	261344
Number of reflections	43522
<I/σ(I)>	13.4
Completeness [%]	99.6	99.7	98.6
Redundancy	6	6.7	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	2.0 M AmSO4, 100 mM MES 6.5 and 5% peg 400