6WIT

Crystal structure of NHP D15.SD7 Fab in complex with 16055 V1V2 1FD6 scaffold

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	74.409, 89.809, 172.782
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.480 - 2.790
R-factor	0.2282
Rwork	0.224
R-free	0.28360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rfo
RMSD bond length	0.005
RMSD bond angle	0.747
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.481	2.850
High resolution limit [Å]	2.790	2.800
Rmerge	0.144	0.927
Rmeas	0.125	0.495
Rpim	0.049	0.573
Number of reflections	28183	1436
<I/σ(I)>	16.05	1.47
Completeness [%]	95.7	66.75
Redundancy	6.2	4.2
CC(1/2)	0.992	0.573

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	0.2 M ammonium sulfate, 0.1 M MES, pH 6.5, 22% PEG8000