1S1J
Crystal Structure of ZipA in complex with indoloquinolizin inhibitor 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.789, 39.461, 70.513 |
Unit cell angles | 90.00, 105.13, 90.00 |
Refinement procedure
Resolution | 19.930 - 2.180 |
R-factor | 0.192 |
Rwork | 0.192 |
R-free | 0.23600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.200 |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 99.000 | 2.250 |
High resolution limit [Å] | 2.170 | 2.170 |
Number of reflections | 14841 | |
<I/σ(I)> | 10.6 | |
Completeness [%] | 98.7 | 92.2 |
Redundancy | 4 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 10-15% PEG 6K, 0.1M MES |