6MTN
Crystal Structure of HIV-1 BG505 SOSIP.664 Prefusion Env Trimer Bound to Small Molecule HIV-1 Entry Inhibitor Compound 484 in Complex with Human Antibodies 3H109L and 35O22 at 3.0 Angstrom
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-11 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 1 |
Spacegroup name | P 63 |
Unit cell lengths | 131.500, 131.500, 315.740 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.043 - 2.500 |
R-factor | 0.225 |
Rwork | 0.223 |
R-free | 0.26260 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.540 |
High resolution limit [Å] | 2.500 | 6.780 | 2.500 |
Rmerge | 0.130 | 0.089 | 1.140 |
Rmeas | 0.148 | 0.101 | 1.369 |
Rpim | 0.069 | 0.047 | 0.742 |
Total number of observations | 241947 | ||
Number of reflections | 54831 | 5380 | 117 |
<I/σ(I)> | 6.1 | ||
Completeness [%] | 50.9 | 98.1 | 2.2 |
Redundancy | 4.4 | 4.5 | 3 |
CC(1/2) | 0.975 | 0.362 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 298 | 60mM Imidazole pH6.5 3% MPD 5% PEG3,350 120mM LiSO$ |