3T11
Dimeric inhibitor of HIV-1 protease.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | Cu FINE FOCUS |
| Temperature [K] | 120 |
| Detector technology | MAR345 |
| Collection date | 2000-03-01 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 30.755, 49.221, 122.524 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.080 - 2.220 |
| R-factor | 0.186 |
| Rwork | 0.183 |
| R-free | 0.25600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1u8g |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.684 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.16) |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.370 | 2.270 |
| High resolution limit [Å] | 2.220 | 2.220 |
| Rmerge | 0.510 | |
| Number of reflections | 9704 | |
| <I/σ(I)> | 9.1 | 1.1 |
| Completeness [%] | 97.8 | 71 |
| Redundancy | 5.7 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
