6T8U
Complement factor B in complex with 5-Bromo-3-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-7-methyl-1H-indol-4-amine
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2010-08-10 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.000 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 91.926, 91.926, 260.415 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 86.684 - 2.840 |
Rwork | 0.198 |
R-free | 0.23890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dle |
RMSD bond length | 0.009 |
RMSD bond angle | 1.714 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 91.910 | 2.930 |
High resolution limit [Å] | 2.840 | 2.840 |
Rmerge | 0.146 | 0.500 |
Rmeas | 0.152 | 0.520 |
Number of reflections | 27309 | 2383 |
<I/σ(I)> | 20.75 | 7.39 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 2.4M AMMONIUM SULPHATE, 0.1 M SODIUM ACETATE PH 4.6 |