4S1D
Structure of IgG1 Fab fragment in complex with Biotincytidinamide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 110 |
| Detector technology | PIXEL |
| Collection date | 2011-10-22 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 89.094, 119.620, 96.181 |
| Unit cell angles | 90.00, 117.15, 90.00 |
Refinement procedure
| Resolution | 119.000 - 2.500 |
| R-factor | 0.22799 |
| Rwork | 0.225 |
| R-free | 0.27446 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | unpublished in house Fab fragment structure |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.994 |
| Data reduction software | XDS |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 119.000 | 2.400 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.057 | |
| Number of reflections | 74645 | |
| <I/σ(I)> | 10.29 | |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 3.47 | 3.53 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.15M ammonium sulfate, 0.1M MES, 15%PEG 4000, pH 6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
