8VJV

Structure of Human Neurolysin in complex with dynorphin A8(1-8) peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-06-29
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97912
Spacegroup name	P 21 21 2
Unit cell lengths	143.168, 60.116, 95.734
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	95.730 - 2.120
R-factor	0.2148
Rwork	0.213
R-free	0.24920
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.001
RMSD bond angle	0.400
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	95.734	2.244
High resolution limit [Å]	2.120	2.123
Rmerge	0.138	2.326
Rmeas	0.146	2.462
Rpim	0.047	0.798
Total number of observations		19296
Number of reflections	42142	2090
<I/σ(I)>	10.3	1.4
Completeness [%]	88.7
Redundancy	9.5	9.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	17.5 ~ 30 % polyethylene glycol 3,350 and 50 ~ 125 mM Bis-Tris HCl buffer, pH 6.5