6B2J
E45A mutant of HIV-1 capsid protein (other crystal form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-04-10 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.033200 |
Spacegroup name | P 6 |
Unit cell lengths | 92.493, 92.493, 57.748 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.000 - 2.210 |
R-factor | 0.2033 |
Rwork | 0.202 |
R-free | 0.22330 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.062 |
Data reduction software | Aimless (0.5.24) |
Data scaling software | Aimless (0.5.24) |
Phasing software | CRANK2 |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 47.000 | 46.840 | 2.280 |
High resolution limit [Å] | 2.210 | 9.110 | 2.210 |
Rmerge | 0.084 | 0.047 | 1.320 |
Rmeas | 0.089 | 0.050 | 1.385 |
Rpim | 0.027 | 0.016 | 0.417 |
Number of reflections | 14252 | 223 | 1218 |
<I/σ(I)> | 17.6 | ||
Completeness [%] | 99.9 | 99.6 | 99.2 |
Redundancy | 11.3 | 10.1 | 10.7 |
CC(1/2) | 0.999 | 0.999 | 0.628 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | PEG3350, NaI, MIB, Glycerol |