5XRQ

Crystal structure of human monoclonal antibody H3v-47

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-03-20
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.033
Spacegroup name	P 31
Unit cell lengths	135.126, 135.126, 78.530
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.920 - 2.600
R-factor	0.1825
Rwork	0.180
R-free	0.21440
RMSD bond length	0.010
RMSD bond angle	1.170
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.610
High resolution limit [Å]	2.570	2.570
Rmerge	0.093	0.412
Rpim	0.058	0.256
Number of reflections	50148	2143
<I/σ(I)>	8.1	1
Completeness [%]	98.2	83.4
Redundancy	3.4
CC(1/2)	0.891	0.891

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	293	20% (w/v) polyethylene glycol (PEG) 6000, 0.1 M sodium citrate (pH 5.0)