9OZJ

Structure of human Sec23a/Sec24a/Sec22b bound to ligand CPD1

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-02
Detector	DECTRIS EIGER R 4M
Wavelength(s)	0.978
Spacegroup name	C 1 2 1
Unit cell lengths	147.639, 96.477, 130.684
Unit cell angles	90.00, 90.36, 90.00

Refinement procedure

Resolution	130.680 - 2.720
R-factor	0.2126
Rwork	0.210
R-free	0.25950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.511
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.21.2_5419: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	130.680	2.780
High resolution limit [Å]	2.720	2.720
Rmerge	0.122
Number of reflections	48747	2854
<I/σ(I)>	9.8
Completeness [%]	98.2
Redundancy	3.7
CC(1/2)		0.790

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	50 mM Tris, pH 7.8, 0.3 M NaAc, 15% PEG4000