5KDU
ZmpB metallopeptidase in complex with a2,6-Sialyl T-antigen
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-05-27 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97926 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 66.140, 68.380, 170.940 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 85.470 - 2.000 |
| R-factor | 0.17018 |
| Rwork | 0.169 |
| R-free | 0.20117 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5kdj |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.459 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 85.470 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.131 | 0.337 |
| Number of reflections | 53306 | |
| <I/σ(I)> | 6.9 | 3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.3 | 6.4 |
| CC(1/2) | 0.992 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | PEG 3350, Na/K tartrate, HEPES pH 7.5 |
