5ZJY

Stapled-peptides tailored against initiation of translation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	CCD
Collection date	2017-01-26
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97995
Spacegroup name	P 31
Unit cell lengths	39.800, 39.800, 110.230
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.470 - 1.590
R-factor	0.18011
Rwork	0.178
R-free	0.21605
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4tpw
RMSD bond length	0.009
RMSD bond angle	1.736
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.680
High resolution limit [Å]	1.590	1.590
Rmerge	0.045	0.592
Number of reflections	26096	4018
<I/σ(I)>	17.56	2.08
Completeness [%]	94.7	99.1
Redundancy	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	295	30%(W/V) PEG 6000, 0.1M Na-Hepes pH6.5