6CDC
GID4 in complex with a tetrapeptide
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 | PIXEL |
| Collection date | 2017-08-27 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97949 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 40.165, 82.531, 54.394 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.400 - 1.750 |
| R-factor | 0.1948 |
| Rwork | 0.193 |
| R-free | 0.23930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | early version of PDB entry 6CCR |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.669 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.32) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.420 | 45.420 | 1.730 |
| High resolution limit [Å] | 1.700 | 9.000 | 1.700 |
| Rmerge | 0.072 | 0.027 | 1.265 |
| Rmeas | 0.079 | 0.031 | 1.617 |
| Rpim | 0.032 | 0.013 | 0.992 |
| Total number of observations | 121005 | 894 | 2114 |
| Number of reflections | 20397 | 947 | |
| <I/σ(I)> | 13.6 | 43.2 | 0.6 |
| Completeness [%] | 99.4 | 99.6 | 88.5 |
| Redundancy | 5.9 | 4.9 | 2.2 |
| CC(1/2) | 0.999 | 0.999 | 0.258 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 30%PEG3350, 0.2M NaCl and 0.1M Tris pH 8.5 |
