3RNQ

Crystal structure of the complex between the extracellular domains of mouse PD-1 mutant and PD-L2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2008-05-07
Detector	ADSC QUANTUM 315
Wavelength(s)	1.071
Spacegroup name	P 1 21 1
Unit cell lengths	36.516, 79.716, 51.693
Unit cell angles	90.00, 105.56, 90.00

Refinement procedure

Resolution	49.810 - 1.600
R-factor	0.184
Rwork	0.183
R-free	0.20680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1npu 3bp6
RMSD bond length	0.012
RMSD bond angle	1.435
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.660
High resolution limit [Å]	1.600	3.450	1.600
Rmerge	0.046	0.040	0.196
Number of reflections	36039
<I/σ(I)>	16.9
Completeness [%]	96.1	99.1	74.7
Redundancy	3.5	3.7	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	0.1M Tris pH 8, 17.5% PEG 6000, Vapor diffusion, Sitting drop, temperature 298K