6Q0M
Structure of Erbin PDZ derivative E-14 with a high-affinity peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-02-18 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 |
| Unit cell lengths | 34.000, 36.040, 38.650 |
| Unit cell angles | 84.33, 76.95, 66.66 |
Refinement procedure
| Resolution | 30.600 - 1.200 |
| R-factor | 0.159 |
| Rwork | 0.156 |
| R-free | 0.18500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Swiss-Modeller model of E-14 PDZ |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.450 | 1.180 |
| High resolution limit [Å] | 1.160 | 1.160 |
| Rmerge | 0.041 | 1.110 |
| Number of reflections | 48498 | 1838 |
| <I/σ(I)> | 15.5 | 1 |
| Completeness [%] | 86.5 | 67 |
| Redundancy | 3.7 | 3.1 |
| CC(1/2) | 0.998 | 0.770 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 297 | 9% PEG8K, 200 mM MgCl2, 100 mM NaAc 4.5 |
