6DBE

Crystal Structure of VHH R330

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-12-12
Detector	RAYONIX MX-300
Wavelength(s)	0.97950
Spacegroup name	P 31 2 1
Unit cell lengths	58.615, 58.615, 100.527
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.313 - 1.650
R-factor	0.1868
Rwork	0.185
R-free	0.22270
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6dba
RMSD bond length	0.010
RMSD bond angle	1.152
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.760	50.760	1.690
High resolution limit [Å]	1.650	7.380	1.650
Rmerge	0.100	0.050	0.497
Number of reflections	24176
<I/σ(I)>	9.5	11.4	3.8
Completeness [%]	98.4	73.9	95.1
Redundancy	4.5	3.2	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	298	0.1M HEPES, 25% PEG 3350