7MAA
HIV-1 Protease (I84V) in Complex with UMass10
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-03-11 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.54178 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.183, 57.928, 62.240 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 21.202 - 1.933 |
R-factor | 0.1846 |
Rwork | 0.182 |
R-free | 0.22680 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6dgx |
RMSD bond length | 0.005 |
RMSD bond angle | 0.788 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 21.210 | 1.960 |
High resolution limit [Å] | 1.930 | 1.930 |
Rmerge | 0.059 | 0.305 |
Number of reflections | 13227 | 1283 |
<I/σ(I)> | 24.5 | 4.3 |
Completeness [%] | 91.8 | 89.2 |
Redundancy | 4.7 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 23-24% (w/v) Ammonium Sulfate, 0.1M Bis-Tris-Methane-HCl Buffer pH 5.5 |