6BXB

Crystal structure of an extended b3 integrin P33

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-13
Detector	MAR CCD 130 mm
Wavelength(s)	0.97872
Spacegroup name	P 1 21 1
Unit cell lengths	59.560, 79.840, 116.160
Unit cell angles	90.00, 91.42, 90.00

Refinement procedure

Resolution	53.520 - 2.390
R-factor	0.2231
Rwork	0.221
R-free	0.26790
RMSD bond length	0.004
RMSD bond angle	0.650
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.520	2.480
High resolution limit [Å]	2.388	2.390
Number of reflections	43236
<I/σ(I)>	9.6
Completeness [%]	99.7
Redundancy	7.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	20% PEG 6000, 0.1 M Tris-HCl (pH 8.5)