3LF9
Crystal structure of HIV epitope-scaffold 4E10_D0_1IS1A_001_C
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 107 |
Detector technology | CCD |
Collection date | 2008-06-04 |
Detector | RIGAKU SATURN 944+ |
Wavelength(s) | 1.54 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 40.660, 75.360, 79.610 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.370 - 2.000 |
R-factor | 0.20697 |
Rwork | 0.204 |
R-free | 0.25969 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Computationally-derived model of the epitope-scaffold based on 1IS1 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.004 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.640 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.052 | 0.185 |
Number of reflections | 8462 | |
<I/σ(I)> | 18.6 | 4 |
Completeness [%] | 98.3 | 89.9 |
Redundancy | 4.53 | 2.66 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | PEG 4000, Ca chloride, Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |