6CXG

anti-HIV-1 Fab 2G12 in complex with glycopeptide 10V1S

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-08-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97950
Spacegroup name	P 21 21 21
Unit cell lengths	45.221, 131.179, 169.541
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.385 - 2.298
R-factor	0.1992
Rwork	0.197
R-free	0.23720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rbp
RMSD bond length	0.009
RMSD bond angle	1.349
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.400	2.340
High resolution limit [Å]	2.298	2.298
Rmerge	0.174	1.000
Rmeas	0.193	1.000
Rpim	0.095	0.506
Number of reflections	45804	2195
<I/σ(I)>	8.8	1.9
Completeness [%]	99.5	97.6
Redundancy	5.4	5.1
CC(1/2)	0.990	0.510

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	295	1M citrate, 10mM sodium borate