4H0H

Crystal structure of mimicry-recognizing 2D10 scFv with peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU300
Temperature [K]	120
Detector technology	IMAGE PLATE
Collection date	2008-12-16
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	80.330, 80.330, 74.980
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.500 - 2.000
R-factor	0.19725
Rwork	0.195
R-free	0.21525
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4h0i
RMSD bond length	0.028
RMSD bond angle	1.865
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.5.0102)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	69.568	2.110
High resolution limit [Å]	2.000	2.000
Rmerge	0.065	0.427
Number of reflections	19310
<I/σ(I)>	24.1	5.5
Completeness [%]	100.0	100
Redundancy	10.5	10.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	277	100 mM MES, pH 6.5, 1.6 M magnesium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 277K