9DON

Crystal structure of eIF4e in complex with Compound 5-PA

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-07-14
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.1271
Spacegroup name	P 1 21 1
Unit cell lengths	49.194, 74.397, 52.454
Unit cell angles	90.00, 97.38, 90.00

Refinement procedure

Resolution	33.500 - 2.091
R-factor	0.2005
Rwork	0.198
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.880
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	BUSTER (2.10.4 (10-JUL-2024))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.091	5.700	2.100
Rmerge	0.102	0.069	0.316
Rmeas	0.114	0.077	0.353
Rpim	0.049	0.034	0.154
Number of reflections	21714	1135	1051
<I/σ(I)>	9.1
Completeness [%]	98.0	98.2	95.8
Redundancy	5.6	5.6	5.2
CC(1/2)	1.000	0.992	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	26% Peg 3350, 0.1 M MES pH 6.0, 10% isopropanol and 2 mM CaCl2