6OCX
Structure of human CIB1 in complex with peptide inhibitor UNC10245109
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-03-05 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 75.866, 33.035, 162.402 |
Unit cell angles | 90.00, 99.85, 90.00 |
Refinement procedure
Resolution | 27.640 - 1.900 |
R-factor | 0.214 |
Rwork | 0.212 |
R-free | 0.24600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xo5 |
RMSD bond length | 0.009 |
RMSD bond angle | 0.920 |
Data reduction software | xia2 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.640 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 63567 | 6305 |
<I/σ(I)> | 5.57 | |
Completeness [%] | 99.5 | |
Redundancy | 6.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 294 | 0.1 M HEPES: NaOH, pH 7.5 20 % (w/v) PEG 8000 |