5HLM
Crystal structure of avidin complex with a ferrocene biotin derivative
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P13 (MX1) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-12-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.07106 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.200, 74.910, 76.180 |
| Unit cell angles | 90.00, 106.17, 90.00 |
Refinement procedure
| Resolution | 37.460 - 2.500 |
| R-factor | 0.20444 |
| Rwork | 0.202 |
| R-free | 0.25354 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vgw |
| RMSD bond length | 0.018 |
| RMSD bond angle | 2.026 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | |
| High resolution limit [Å] | 2.500 | |
| Rmerge | 0.048 | 0.396 |
| Number of reflections | 14959 | |
| <I/σ(I)> | 12.57 | 2.86 |
| Completeness [%] | 91.8 | |
| Redundancy | 2.93 | 2.53 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 292.15 | 0.2M potassium thiocyanate, 0.1M BIS-TRIS pH 6.5 and 22% w/v polyethylene glycol 3350 |
