3GHE
Crystal structure of anti-HIV-1 Fab 537-10D in complex with V3 peptide MN
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 | 2008-02-29 |
| Detector | MAR CCD 165 mm |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.363, 71.322, 77.124 |
| Unit cell angles | 90.00, 104.25, 90.00 |
Refinement procedure
| Resolution | 29.950 - 2.400 |
| R-factor | 0.187 |
| Rwork | 0.187 |
| R-free | 0.24100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | CRYSTAL STRUCTURE OF 2557 FAB WITH V3 PEPTIDE NY5 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.370 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.950 | 2.060 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rmerge | 0.085 | 0.494 |
| Number of reflections | 23276 | |
| <I/σ(I)> | 2 | |
| Completeness [%] | 73.1 | 8 |
| Redundancy | 5.4 | 1.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 296.15 | 20% PEG 4000, 5% Isoproponal, 0.1M Hepes pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 296.15K |
