3LH2

Crystal structure of HIV epitope-scaffold 4E10_1VI7A_S0_002_N 4E10 Fv complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	107
Detector technology	CCD
Collection date	2008-10-22
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	75.850, 145.950, 78.550
Unit cell angles	90.00, 92.43, 90.00

Refinement procedure

Resolution	26.700 - 2.650
R-factor	0.22426
Rwork	0.222
R-free	0.27023
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Computationally-derived model of the epitope-scaffold Fv complex with the Fv based on PDB ID 1TZG.
RMSD bond length	0.006
RMSD bond angle	0.927
Data reduction software	d*TREK
Data scaling software	d*TREK
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.010	2.740
High resolution limit [Å]	2.650	2.650
Rmerge	0.095	0.376
Number of reflections	49017
<I/σ(I)>	9.4	2.7
Completeness [%]	98.9	98.6
Redundancy	3.88	3.68

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	298	Na acetate, imidazole, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 298K