3U71
Crystal Structure Analysis of South African wild type HIV-1 Subtype C Protease
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 2009-10-05 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 45.928, 45.928, 99.960 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.730 - 2.720 |
| R-factor | 0.2195 |
| Rwork | 0.217 |
| R-free | 0.28260 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2r8n |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.776 |
| Data reduction software | SAINT (V7.68A) |
| Data scaling software | SAINT (V7.68A) |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 49.980 | 2.794 | |
| High resolution limit [Å] | 2.697 | 5.809 | 2.697 |
| Number of reflections | 3193 | ||
| <I/σ(I)> | 91.204 | ||
| Completeness [%] | 98.8 | ||
| Redundancy | 8.18 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0.2 M sodium citrate tribasic dihydrate, 20% w/v PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
