4Z2V

Crystal structure of short hoefavidin-hoef-peptide complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-06-26
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.96
Spacegroup name	P 43 21 2
Unit cell lengths	60.740, 60.740, 166.800
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	57.070 - 1.390
R-factor	0.16161
Rwork	0.160
R-free	0.18659
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4z27
RMSD bond length	0.012
RMSD bond angle	1.510
Data reduction software	MOSFLM
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0071)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.070	1.430
High resolution limit [Å]	1.390	1.390
Number of reflections	61114
<I/σ(I)>	19.4
Completeness [%]	95.0
Redundancy	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M NaCl, 0.1 M Bis-Tris pH 6.2-7.0 and 1.1-1.5 M ammonium sulfate