6MTR

Crystal structure of VRC43.01 Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2016-02-26
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.000
Spacegroup name	C 1 2 1
Unit cell lengths	163.075, 54.661, 66.113
Unit cell angles	90.00, 113.30, 90.00

Refinement procedure

Resolution	36.863 - 1.798
R-factor	0.2108
Rwork	0.209
R-free	0.24340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	homology model of VRC43.01
RMSD bond length	0.011
RMSD bond angle	1.223
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.830
High resolution limit [Å]	1.798	1.800
Rmerge	0.111	0.733
Rpim	0.067	0.440
Number of reflections	42070
<I/σ(I)>	13
Completeness [%]	84.8
Redundancy	3.7
CC(1/2)	0.883	0.556

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	293	34% PEG 4000, 0.2M Ammonium Acetate, 0.1M Na Citrate 5.6