3UJJ
Crystal structure of anti-HIV-1 V3 Fab 4025 in complex with Con A peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4C |
| Synchrotron site | NSLS |
| Beamline | X4C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-03-12 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.97883 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 136.143, 136.143, 73.411 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.301 - 2.000 |
| R-factor | 0.1784 |
| Rwork | 0.177 |
| R-free | 0.21340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB ID 2B0S |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.149 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.7.2_869)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Number of reflections | 52523 | |
| <I/σ(I)> | 17.3 | |
| Completeness [%] | 91.1 | 67.4 |
| Redundancy | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 3.8 | 296 | 1.6 M ammonium sulfate, 80 mM sodium acetate, 30% glycerol, pH 3.8, EVAPORATION, temperature 296K |
