6JI5
brd4-bd1 bound with ligand 167
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-12-25 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97915 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 33.449, 48.146, 79.374 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.624 - 2.000 |
R-factor | 0.2038 |
Rwork | 0.200 |
R-free | 0.26190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5xi3 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.204 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.624 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.164 | 0.361 |
Number of reflections | 8224 | 991 |
<I/σ(I)> | 18.4 | |
Completeness [%] | 90.2 | |
Redundancy | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 293 | 3.2-3.8 M NAFORMATE,10% GLYCEROL |