5VJO

Complex between HyHEL10 Fab fragment heavy chain mutant I29F and Pekin duck egg lysozyme isoform I (DEL-I)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-03
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9537
Spacegroup name	P 21 2 21
Unit cell lengths	89.020, 102.910, 133.980
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.490 - 2.430
R-factor	0.2638
Rwork	0.262
R-free	0.29590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5v8g 3d9a
RMSD bond length	0.011
RMSD bond angle	1.439
Data reduction software	MOSFLM
Data scaling software	Aimless (0.5.31)
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.490	47.490	2.510
High resolution limit [Å]	2.430	9.400	2.430
Rmerge	0.095	0.047	0.770
Rmeas	0.100	0.050	0.814
Rpim	0.032	0.016	0.261
Total number of observations	459563
Number of reflections	47296
<I/σ(I)>	15.5
Completeness [%]	99.9	95.8	100
Redundancy	9.7	9	9.5
CC(1/2)	0.998	0.998	0.850

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	4.75	293	100 mM sodium citrate (pH 4.75), 17% (w/v) PEG3350