6HIG

hPD-1/NBO1a Fab complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-10-10
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97625
Spacegroup name	P 1 21 1
Unit cell lengths	64.514, 63.049, 68.297
Unit cell angles	90.00, 106.49, 90.00

Refinement procedure

Resolution	65.489 - 2.200
R-factor	0.2174
Rwork	0.215
R-free	0.26970
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4zqk 4q9q
RMSD bond length	0.002
RMSD bond angle	0.479
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	65.490	2.270
High resolution limit [Å]	2.200	2.200
Rmerge	0.070	0.520
Rmeas	0.085	0.645
Number of reflections	26237	2261
<I/σ(I)>	10.77	2.16
Completeness [%]	97.6	98.28
Redundancy	2.9	2.7
CC(1/2)	0.997	0.711

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		293	0.2 M NH4I 20 % PEG 3.35 K