5KD5
BT_4244 metallopeptidase from Bacteroides thetaiotaomicron
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 | 2015-07-08 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 86.860, 88.440, 99.020 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.680 - 1.650 |
| R-factor | 0.18763 |
| Rwork | 0.186 |
| R-free | 0.22067 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5kd2 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.647 |
| 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] | 38.680 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.085 | 0.463 |
| Number of reflections | 92144 | |
| <I/σ(I)> | 13.8 | 2.1 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 9.5 | 9.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | PEG 3350, NaH2PO4, Tris-HCl pH 8.0 |
