4JWY

GluN2D ligand-binding core in complex with propyl-NHP5G

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	100
Wavelength(s)	1.10
Spacegroup name	C 2 2 21
Unit cell lengths	59.996, 113.899, 95.695
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.456 - 2.000
R-factor	0.1929
Rwork	0.191
R-free	0.23320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3oen
RMSD bond length	0.008
RMSD bond angle	1.172
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	2.000
Number of reflections	22209
Completeness [%]	98.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	291	100 mM CAPS, 3.5-4.5 M sodium formate, 8-12% 1,4-butanediol, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K