5CBO

Fusion protein of mbp3-16 and B4 domain of protein A from staphylococcal aureus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	77
Detector technology	CCD
Collection date	2013-07-22
Detector	ADSC QUANTUM 315
Wavelength(s)	1.00000
Spacegroup name	P 1 21 1
Unit cell lengths	85.497, 220.393, 85.524
Unit cell angles	90.00, 59.97, 90.00

Refinement procedure

Resolution	33.060 - 2.802
R-factor	0.2075
Rwork	0.203
R-free	0.25350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5cbn
RMSD bond length	0.009
RMSD bond angle	1.024
Data scaling software	SCALEPACK
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.900
High resolution limit [Å]	2.800	6.030	2.800
Rmerge	0.051	0.041	0.152
Total number of observations	199816
Number of reflections	62318
<I/σ(I)>	16.1
Completeness [%]	93.0	97.6	82.2
Redundancy	3.2	3.5	3.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	5.5	298	34% w/v PPG P-400 10mM Hexaamine cobalt(III) chloride