8QUH
Hexameric HIV-1 CA in complex with DDD00057456
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-07-16 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 6 |
| Unit cell lengths | 90.550, 90.550, 56.820 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 56.820 - 1.550 |
| R-factor | 0.17887 |
| Rwork | 0.178 |
| R-free | 0.19516 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.260 |
| Data reduction software | XDS |
| Data scaling software | xia2 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.820 | 1.580 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.050 | 1.250 |
| Number of reflections | 38608 | 1911 |
| <I/σ(I)> | 20.2 | |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 9.4 | 5.6 |
| CC(1/2) | 0.990 | 0.520 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 290 | 0.1M Tris buffer, pH 8.0 to 9.0, 10-15% PEG550MME, 0.15M KSCN |
