4AFG
Capitella teleta AChBP in complex with varenicline
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 79.236, 112.549, 134.654 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.429 - 2.001 |
R-factor | 0.1746 |
Rwork | 0.172 |
R-free | 0.22270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2uz6 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.299 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE: 1.7.3_928)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.430 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.010 | 0.060 |
Number of reflections | 81577 | |
<I/σ(I)> | 9.1 | 1.2 |
Completeness [%] | 99.7 | 98.3 |
Redundancy | 4.4 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |