9GIB

NMDA bound to compound 380

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-21
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9159
Spacegroup name	P 21 21 21
Unit cell lengths	53.972, 90.036, 123.174
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	72.700 - 1.948
Rwork	0.203
R-free	0.25640
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.494
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	72.700	2.000
High resolution limit [Å]	1.948	1.950
Rmerge	0.143	0.823
Rpim	0.061	0.370
Number of reflections	44610	3252
<I/σ(I)>	8.2	2.2
Completeness [%]	100.0	100
Redundancy	6.4	5.9
CC(1/2)	0.996	0.613

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	282.15	10-15% PEG 3350, 0.1 M HEPES pH 7.0, 1 mM sodium azide, 1% tryptone