5BN0
A new HIV fusion peptide inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-02 |
| Detector | RIGAKU SATURN 944+ |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 77.150, 52.340, 60.260 |
| Unit cell angles | 90.00, 117.46, 90.00 |
Refinement procedure
| Resolution | 26.735 - 2.800 |
| R-factor | 0.2715 |
| Rwork | 0.271 |
| R-free | 0.28830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.155 |
| Data reduction software | d*TREK |
| Data scaling software | CrystalClear |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 26.740 |
| High resolution limit [Å] | 2.800 |
| Number of reflections | 11921 |
| <I/σ(I)> | 22.3 |
| Completeness [%] | 92.3 |
| Redundancy | 2.27 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 0.1 M Calcium chloride 0.1 M Sodium acetate pH 4.6 15 %PEG 400 |
