5K8G
Crystal structure of a putative peptide-binding domain of MpAFP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 93 |
| Detector technology | CCD |
| Collection date | 2016-02-12 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.115, 61.065, 63.473 |
| Unit cell angles | 66.25, 72.66, 67.94 |
Refinement procedure
| Resolution | 47.640 - 2.000 |
| R-factor | 0.1851 |
| Rwork | 0.183 |
| R-free | 0.22143 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | SAD model |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.721 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0151) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.640 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.207 | 1.790 |
| Number of reflections | 41606 | |
| <I/σ(I)> | 6.4 | 0.9 |
| Completeness [%] | 98.0 | 96.8 |
| Redundancy | 4.4 | 4.4 |
| CC(1/2) | 0.368 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 4.6 | 296 | Calcium chloride, sodium acetate, PEG400 |
