4CVQ
CRYSTAL STRUCTURE OF AN AMINOTRANSFERASE FROM ESCHERICHIA COLI AT 2. 11 ANGSTROEM RESOLUTION
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 59.780, 152.130, 174.240 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.162 - 2.110 |
R-factor | 0.2059 |
Rwork | 0.204 |
R-free | 0.24660 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xi9 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.830 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.880 | 2.220 |
High resolution limit [Å] | 2.110 | 2.110 |
Rmerge | 0.080 | 0.670 |
Number of reflections | 46169 | |
<I/σ(I)> | 14.1 | 3 |
Completeness [%] | 99.9 | 100 |
Redundancy | 8 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |