6FR4
003 TCR Study of CDR Loop Flexibility
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-03-16 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.280, 81.290, 65.090 |
| Unit cell angles | 90.00, 90.30, 90.00 |
Refinement procedure
| Resolution | 43.280 - 1.280 |
| R-factor | 0.16875 |
| Rwork | 0.168 |
| R-free | 0.19027 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6eh4 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.977 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.280 | 1.310 |
| High resolution limit [Å] | 1.280 | 1.280 |
| Rmerge | 0.042 | 0.423 |
| Rmeas | 0.049 | 0.543 |
| Number of reflections | 109519 | 5708 |
| <I/σ(I)> | 15.5 | |
| Completeness [%] | 94.8 | 67.1 |
| Redundancy | 3.6 | 2.6 |
| CC(1/2) | 0.996 | 0.725 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 291 | .1M Na Acetate, 0.1M CaCl2, 30% PEG 400 |
