3AHA
Crystal structure of the complex between gp41 fragments N36 and C34 mutant N126K/E137Q
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-08-22 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 88.632, 50.479, 56.154 |
Unit cell angles | 90.00, 90.88, 90.00 |
Refinement procedure
Resolution | 23.880 - 1.700 |
R-factor | 0.19021 |
Rwork | 0.189 |
R-free | 0.21933 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1aik |
RMSD bond length | 0.010 |
RMSD bond angle | 0.989 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 1.740 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.072 | |
Number of reflections | 27434 | |
Completeness [%] | 99.1 | 99.95 |
Redundancy | 3.61 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 80mM ammonium chloride, 16% 2-methylpentan-2,4-diol, 25% isopropanol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |